methyl (E)-4-[(3-cyanophenyl)-[2-(4-nitrophenyl)ethyl]amino]but-2-enoate

Systemtic Name: methyl (E)-4-[(3-cyanophenyl)-[2-(4-nitrophenyl)ethyl]amino]but-2-enoate Openeye Name: methyl (E)-4-[3-cyano-N-[2-(4-nitrophenyl)ethyl]anilino]but-2-enoate CAS Name: (E)-4-[3-cyano-N-[2-(4-nitrophenyl)ethyl]anilino]-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4-[3-cyano-N-[2-(4-nitrophenyl)ethyl]anilino]but-2-enoate Traditional Name: (E)-4-[3-cyano-N-[2-(4-nitrophenyl)ethyl]anilino]but-2-enoic acid methyl ester Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CCN(CCC1=CC=C(C=C1)[N+](=O)[O-])C2=CC=CC(=C2)C#N

Isomeric SMILES

COC(=O)/C=C/CN(CCC1=CC=C(C=C1)[N+](=O)[O-])C2=CC=CC(=C2)C#N

InChI

InChI=1S/C20H19N3O4/c1-27-20(24)6-3-12-22(19-5-2-4-17(14-19)15-21)13-11-16-7-9-18(10-8-16)23(25)26/h2-10,14H,11-13H2,1H3/b6-3+