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carfentanil

PropertiesImage
MNX_IDMNXM153174 Image of MNXM153174
referencechebi:61084
formulaC24H30N2O3
global charge0
mol weight394.515
InChIKeyYDSDEBIZUNNPOB-UHFFFAOYSA-N
InChIInChI=1S/C24H30N2O3/c1-3-22(27)26(21-12-8-5-9-13-21)24(23(28)29-2)15-18-25(19-16-24)17-14-20-10-6-4-7-11-20/h4-13H,3,14-19H2,1-2H3
SMILESCCC(=O)N(C1=CC=CC=C1)C1(C(=O)OC)CCN(CCC2=CC=CC=C2)CC1
MNX internals
InChI (mnx)InChI=1/C24H30N2O3/c1-3-22(27)26(21-12-8-5-9-13-21)24(23(28)29-2)15-18-25(19-16-24)17-14-20-10-6-4-7-11-20/h4-13H,3,14-19H2,1-2H3 Image of MNXM153174
SMILES (mnx)[CH3:1][CH2:3][C:22]([N:26]([C:21]1=[CH:12][CH:8]=[CH:5][CH:9]=[CH:13]1)[C:24]1([C:23](=[O:28])[O:29][CH3:2])[CH2:15][CH2:18][N:25]([CH2:17][CH2:14][C:20]2=[CH:10][CH:6]=[CH:4][CH:7]=[CH:11]2)[CH2:19][CH2:16]1)=[O:27]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:61084
chebi:61084
YDSDEBIZUNNPOB-UHFFFAOYSA-N 		carfentanil
4-((1-Oxopropyl)phenylamino)-1-(2-phenylethyl)-4-piperidinecarboxylic acid methyl ester
Methyl 1-phenylethyl-4-(N-phenylpropionamido)isonipecotate
Methyl 4-(N-(1-oxopropyl)-N-phenylamino)-1-(2-phenylethyl)-4-piperidinecarboxylate
Methyl 4-(N-propionyl-N-phenylamino)-1-(2-phenylethyl)-4-piperidine-carboxylate
Wildnil
carfentanilo
carfentanilum
carfentanyl
methyl 1-(2-phenylethyl)-4-[phenyl(propionyl)amino]piperidine-4-carboxylate

kegg.drug:D07620
keggD:D07620
YDSDEBIZUNNPOB-UHFFFAOYSA-N 		Carfentanil (INN)

keggD:M_D07620 		secondary/obsolete/fantasy identifier