(E)-2-cyano-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-methyl-3-nitro-phenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-methyl-3-nitro-phenyl)prop-2-enamide Openeye Name: (E)-2-cyano-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-methyl-3-nitro-phenyl)prop-2-enamide CAS Name: (E)-2-cyano-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-methyl-3-nitrophenyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-methyl-3-nitrophenyl)prop-2-enamide Traditional Name: (E)-2-cyano-N-homoveratryl-3-(4-methyl-3-nitro-phenyl)acrylamide Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C=C(C#N)C(=O)NCCC2=CC(=C(C=C2)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NCCC2=CC(=C(C=C2)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O5/c1-14-4-5-16(11-18(14)24(26)27)10-17(13-22)21(25)23-9-8-15-6-7-19(28-2)20(12-15)29-3/h4-7,10-12H,8-9H2,1-3H3,(H,23,25)/b17-10+