(Z)-2-cyano-3-(3-ethoxy-5-nitro-4-oxidanyl-phenyl)-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide

Systemtic Name: (Z)-2-cyano-3-(3-ethoxy-5-nitro-4-oxidanyl-phenyl)-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide Openeye Name: (Z)-2-cyano-3-(3-ethoxy-4-hydroxy-5-nitro-phenyl)-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide CAS Name: (Z)-2-cyano-3-(3-ethoxy-4-hydroxy-5-nitrophenyl)-N-[2-(1H-indol-3-yl)ethyl]-2-propenamide IUPAC Name: (Z)-2-cyano-3-(3-ethoxy-4-hydroxy-5-nitrophenyl)-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide Traditional Name: (Z)-2-cyano-3-(3-ethoxy-4-hydroxy-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:

CCOC1=CC(=CC(=C1O)[N+](=O)[O-])C=C(C#N)C(=O)NCCC2=CNC3=CC=CC=C32

Isomeric SMILES

CCOC1=CC(=CC(=C1O)[N+](=O)[O-])/C=C(/C#N)\C(=O)NCCC2=CNC3=CC=CC=C32

InChI

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