2-cyano-N-[2-(1H-indol-3-yl)ethyl]-3-(2-methoxy-5-nitro-phenyl)prop-2-enamide

Systemtic Name: 2-cyano-N-[2-(1H-indol-3-yl)ethyl]-3-(2-methoxy-5-nitro-phenyl)prop-2-enamide Openeye Name: 2-cyano-N-[2-(1H-indol-3-yl)ethyl]-3-(2-methoxy-5-nitro-phenyl)prop-2-enamide CAS Name: 2-cyano-N-[2-(1H-indol-3-yl)ethyl]-3-(2-methoxy-5-nitrophenyl)-2-propenamide IUPAC Name: 2-cyano-N-[2-(1H-indol-3-yl)ethyl]-3-(2-methoxy-5-nitrophenyl)prop-2-enamide Traditional Name: 2-cyano-N-[2-(1H-indol-3-yl)ethyl]-3-(2-methoxy-5-nitro-phenyl)acrylamide Formula: C21H18N4O4 MolecularWeight: 390.39202

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])C=C(C#N)C(=O)NCCC2=CNC3=CC=CC=C32

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])C=C(C#N)C(=O)NCCC2=CNC3=CC=CC=C32

InChI

InChI=1S/C21H18N4O4/c1-29-20-7-6-17(25(27)28)11-15(20)10-16(12-22)21(26)23-9-8-14-13-24-19-5-3-2-4-18(14)19/h2-7,10-11,13,24H,8-9H2,1H3,(H,23,26)