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

Systemtic Name: 2-methoxyethyl (E)-2-cyano-3-[4-[methyl(phenyl)amino]-3-nitro-phenyl]prop-2-enoate Openeye Name: 2-methoxyethyl (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 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (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 2-methoxyethyl ester Formula: C20H19N3O5 MolecularWeight: 381.38196

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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)OCCOC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C20H19N3O5/c1-22(17-6-4-3-5-7-17)18-9-8-15(13-19(18)23(25)26)12-16(14-21)20(24)28-11-10-27-2/h3-9,12-13H,10-11H2,1-2H3/b16-12+