CHEBI:104063 - 2-amino-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium-3-carbonitrile

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-amino-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium-3-carbonitrile
ChEBI ID CHEBI:104063
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C18H12N5O2
Net Charge +1
Average Mass 330.321
Monoisotopic Mass 330.09855
InChI InChI=1S/C18H11N5O2/c19-10-11-9-16-17(14-3-1-2-4-15(14)21-16)22(18(11)20)12-5-7-13(8-6-12)23(24)25/h1-9H,(H2,20,21)/p+1
InChIKey WQWZXDYPFLOXKI-UHFFFAOYSA-O
SMILES C1=CC=C2C(=C1)C3=C(N2)C=C(C(=[N+]3C4=CC=C(C=C4)[N+](=O)[O-])N)C#N
ChEBI Ontology
Outgoing 2-amino-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium-3-carbonitrile (CHEBI:104063) is a indoles (CHEBI:24828)
Manual Xref Database
LSM-15421 LINCS
View more database links