ethyl (E)-2-cyano-3-[(5-nitro-2-phenylazanyl-phenyl)amino]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[(5-nitro-2-phenylazanyl-phenyl)amino]prop-2-enoate Openeye Name: ethyl (E)-3-(2-anilino-5-nitro-anilino)-2-cyano-prop-2-enoate CAS Name: (E)-3-(2-anilino-5-nitroanilino)-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(2-anilino-5-nitroanilino)-2-cyanoprop-2-enoate Traditional Name: (E)-3-(2-anilino-5-nitro-anilino)-2-cyano-acrylic acid ethyl ester Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=C(C=CC(=C1)[N+](=O)[O-])NC2=CC=CC=C2)C#N

Isomeric SMILES

CCOC(=O)/C(=C/NC1=C(C=CC(=C1)[N+](=O)[O-])NC2=CC=CC=C2)/C#N

InChI

InChI=1S/C18H16N4O4/c1-2-26-18(23)13(11-19)12-20-17-10-15(22(24)25)8-9-16(17)21-14-6-4-3-5-7-14/h3-10,12,20-21H,2H2,1H3/b13-12+