methyl 4-[(E)-3-[(2-methoxy-4-nitro-phenyl)amino]-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-[(2-methoxy-4-nitro-phenyl)amino]-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-(2-methoxy-4-nitro-anilino)-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-(2-methoxy-4-nitroanilino)-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-(2-methoxy-4-nitroanilino)-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-keto-3-(2-methoxy-4-nitro-anilino)prop-1-enyl]benzoic acid methyl ester Formula: C18H16N2O6 MolecularWeight: 356.32944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C=CC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)/C=C/C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C18H16N2O6/c1-25-16-11-14(20(23)24)8-9-15(16)19-17(21)10-5-12-3-6-13(7-4-12)18(22)26-2/h3-11H,1-2H3,(H,19,21)/b10-5+