prop-2-enyl (E)-2-cyano-3-[4-[methyl(phenyl)amino]-3-nitro-phenyl]prop-2-enoate

Systemtic Name: prop-2-enyl (E)-2-cyano-3-[4-[methyl(phenyl)amino]-3-nitro-phenyl]prop-2-enoate Openeye Name: allyl (E)-2-cyano-3-[4-(N-methylanilino)-3-nitro-phenyl]prop-2-enoate CAS Name: (E)-2-cyano-3-[4-(N-methylanilino)-3-nitrophenyl]-2-propenoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (E)-2-cyano-3-[4-(N-methylanilino)-3-nitrophenyl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[4-(N-methylanilino)-3-nitro-phenyl]acrylic acid allyl ester Formula: C20H17N3O4 MolecularWeight: 363.36668

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C2=C(C=C(C=C2)C=C(C#N)C(=O)OCC=C)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C20H17N3O4/c1-3-11-27-20(24)16(14-21)12-15-9-10-18(19(13-15)23(25)26)22(2)17-7-5-4-6-8-17/h3-10,12-13H,1,11H2,2H3/b16-12+