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

Systemtic Name: methyl 4-[(E)-3-[(4-aminocarbonyl-2-nitro-phenyl)methoxy]-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-[(4-carbamoyl-2-nitro-phenyl)methoxy]-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-[(4-carbamoyl-2-nitrophenyl)methoxy]-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-[(4-carbamoyl-2-nitrophenyl)methoxy]-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-(4-carbamoyl-2-nitro-benzyl)oxy-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C19H16N2O7 MolecularWeight: 384.33954

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=CC(=O)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C/C(=O)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C19H16N2O7/c1-27-19(24)13-5-2-12(3-6-13)4-9-17(22)28-11-15-8-7-14(18(20)23)10-16(15)21(25)26/h2-10H,11H2,1H3,(H2,20,23)/b9-4+