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

Systemtic Name: propan-2-yl (E)-2-cyano-3-[4-[methyl(phenyl)amino]-3-nitro-phenyl]prop-2-enoate Openeye Name: isopropyl (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 propan-2-yl ester IUPAC Name: propan-2-yl (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 isopropyl ester Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N3O4/c1-14(2)27-20(24)16(13-21)11-15-9-10-18(19(12-15)23(25)26)22(3)17-7-5-4-6-8-17/h4-12,14H,1-3H3/b16-11+