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sertraline

Properties

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Occurences in reactions

MNX_ID

MNXM161036

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₁₇H₁₇Cl₂N

charge

mass

305.0738

reference

chebi:9123

InChIKey

VGKDLMBJGBXTGI-SJCJKPOMSA-N

InChI

InChI=1S/C17H17Cl2N/c1-20-17-9-7-12(13-4-2-3-5-14(13)17)11-6-8-15(18)16(19)10-11/h2-6,8,10,12,17,20H,7,9H2,1H3/t12-,17-/m0/s1

SMILES

CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:9123 chebi:9123	sertraline (+)-sertraline (1S,4S)-4-(3,4-dichlorophenyl)-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine (1S,4S)-sertraline (1S-cis)-1,2,3,4-tetrahydro-4-(3,4-dichlorophenyl)-N-methyl-1-naphthalenamine CP 51974 Sertraline cis-(+)-sertraline sertralina sertralinum
seed.compound:cpd04471 seedM:cpd04471 kegg.compound:C07246 keggC:C07246	Sertraline
kegg.drug:D02360 keggD:D02360	Sertraline (INN)
hmdb:HMDB0005010	Sertraline (+)-Sertraline (1S,4S)-4-(3,4-dichlorophenyl)-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine (1S,4S)-Sertraline (1S-cis)-1,2,3,4-Tetrahydro-4-(3,4-dichlorophenyl)-N-methyl-1-naphthalenamine Altruline Apo sertraline Apo-sertraline Apotex brand OF sertraline hydrochloride Aremis Besitran Boehringer ingelheim brand OF sertraline hydrochloride CP 51974 Esteve brand OF sertraline hydrochloride Gen sertraline Gen-sertraline Genpharm brand OF sertraline hydrochloride Gladem Hydrochloride, sertraline Lacer brand OF sertraline hydrochloride Lustral Novo sertraline Novo-sertraline Novopharm brand OF sertraline hydrochloride Parke davis brand OF sertraline hydrochloride Pfizer brand OF sertraline hydrochloride Ratio sertraline Ratio-sertraline Ratiopharm brand OF sertraline hydrochloride Rhoxal sertraline Rhoxal-sertraline Rhoxalpharma brand OF sertraline hydrochloride Roerig brand OF sertraline hydrochloride Sealdin Sertralina Sertraline hydrochloride Sertraline hydrochloride (1S-cis)-isomer Sertralinum Zoloft cis-(+)-Sertraline sertraline
CHEBI:64214 chebi:64214	sertraline(1+) (1S,4S)-4-(3,4-dichlorophenyl)-N-methyl-1,2,3,4-tetrahydronaphthalen-1-aminium
hmdb:HMDB05010 keggC:M_C07246 keggD:M_D02360 seedM:M_cpd04471	secondary/obsolete/fantasy identifier