(E)-2-cyano-N-(4-methyl-2-nitro-phenyl)-3-[1-(phenylmethyl)indol-3-yl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(4-methyl-2-nitro-phenyl)-3-[1-(phenylmethyl)indol-3-yl]prop-2-enamide Openeye Name: (E)-3-(1-benzylindol-3-yl)-2-cyano-N-(4-methyl-2-nitro-phenyl)prop-2-enamide CAS Name: (E)-2-cyano-N-(4-methyl-2-nitrophenyl)-3-[1-(phenylmethyl)-3-indolyl]-2-propenamide IUPAC Name: (E)-3-(1-benzylindol-3-yl)-2-cyano-N-(4-methyl-2-nitrophenyl)prop-2-enamide Traditional Name: (E)-3-(1-benzylindol-3-yl)-2-cyano-N-(4-methyl-2-nitro-phenyl)acrylamide Formula: C26H20N4O3 MolecularWeight: 436.462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(=CC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4)C#N)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)/C(=C/C2=CN(C3=CC=CC=C32)CC4=CC=CC=C4)/C#N)[N+](=O)[O-]

InChI

InChI=1S/C26H20N4O3/c1-18-11-12-23(25(13-18)30(32)33)28-26(31)20(15-27)14-21-17-29(16-19-7-3-2-4-8-19)24-10-6-5-9-22(21)24/h2-14,17H,16H2,1H3,(H,28,31)/b20-14+