(E)-2-cyano-3-(2,4-dimethoxy-5-nitro-phenyl)-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(2,4-dimethoxy-5-nitro-phenyl)-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide Openeye Name: (E)-2-cyano-3-(2,4-dimethoxy-5-nitro-phenyl)-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide CAS Name: (E)-2-cyano-3-(2,4-dimethoxy-5-nitrophenyl)-N-[2-(1H-indol-3-yl)ethyl]-2-propenamide IUPAC Name: (E)-2-cyano-3-(2,4-dimethoxy-5-nitrophenyl)-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide Traditional Name: (E)-2-cyano-3-(2,4-dimethoxy-5-nitro-phenyl)-N-[2-(1H-indol-3-yl)ethyl]acrylamide Formula: C22H20N4O5 MolecularWeight: 420.418

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C=C(C#N)C(=O)NCCC2=CNC3=CC=CC=C32)[N+](=O)[O-])OC

Isomeric SMILES

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

InChI

InChI=1S/C22H20N4O5/c1-30-20-11-21(31-2)19(26(28)29)10-15(20)9-16(12-23)22(27)24-8-7-14-13-25-18-6-4-3-5-17(14)18/h3-6,9-11,13,25H,7-8H2,1-2H3,(H,24,27)/b16-9+