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monodechloroaminopyrrolnitrin

PropertiesImage
MNX_IDMNXM12280 Image of MNXM12280
referencechebi:85785
formulaC10H9ClN2
global charge0
mol weight192.649
InChIKeyVLWKKIHFPGKVHZ-UHFFFAOYSA-N
InChIInChI=1S/C10H9ClN2/c11-9-3-1-2-8(10(9)12)7-4-5-13-6-7/h1-6,13H,12H2
SMILESNC1=C(C2=CNC=C2)C=CC=C1Cl
MNX internals
InChI (mnx)InChI=1/C10H9ClN2/c11-9-3-1-2-8(10(9)12)7-4-5-13-6-7/h1-6,13H,12H2 Image of MNXM12280
SMILES (mnx)[CH:1]1=[CH:2][C:8]([C:7]2=[CH:6][NH:13][CH:5]=[CH:4]2)=[C:10]([NH2:12])[C:9]([Cl:11])=[CH:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)6
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:85785
chebi:85785
VLWKKIHFPGKVHZ-UHFFFAOYSA-N 		monodechloroaminopyrrolnitrin
2-chloro-6-(1H-pyrrol-3-yl)aniline
2-chloro-6-(1H-pyrrol-3-yl)benzenamine
2-chloro-6-(pyrrol-3-yl)aniline
4-(2-amino-3-chlorophenyl)pyrrole

seed.compound:cpd23570
seedM:cpd23570
VLWKKIHFPGKVHZ-UHFFFAOYSA-N 		2-chloro-6-(1H-pyrrol-3-yl)aniline
2-chloro-6-(1H-pyrrol-3-yl)benzenamine
4-(2-amino-3-chlorophenyl)pyrrole
monodechloroaminopyrrolnitrin

kegg.compound:C21110
keggC:C21110
VLWKKIHFPGKVHZ-UHFFFAOYSA-N 		Monodechloroaminopyrrolnitrin

metacyc.compound:CPD-12774
metacycM:CPD-12774
VLWKKIHFPGKVHZ-UHFFFAOYSA-N 		monodechloroaminopyrrolnitrin
2-chloro-6-(1H-pyrrol-3-yl)aniline
2-chloro-6-(1H-pyrrol-3-yl)benzenamine
4-(2-amino-3-chlorophenyl)pyrrole

keggC:M_C21110
seedM:M_cpd23570 		secondary/obsolete/fantasy identifier