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

Systemtic Name: methyl 4-[(E)-3-[2-(4-methyl-3-nitro-phenyl)-2-oxidanylidene-ethoxy]-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-[2-(4-methyl-3-nitro-phenyl)-2-oxo-ethoxy]-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-[2-(4-methyl-3-nitrophenyl)-2-oxoethoxy]-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-[2-(4-methyl-3-nitrophenyl)-2-oxoethoxy]-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-keto-3-[2-keto-2-(4-methyl-3-nitro-phenyl)ethoxy]prop-1-enyl]benzoic acid methyl ester Formula: C20H17NO7 MolecularWeight: 383.35148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)COC(=O)C=CC2=CC=C(C=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C20H17NO7/c1-13-3-7-16(11-17(13)21(25)26)18(22)12-28-19(23)10-6-14-4-8-15(9-5-14)20(24)27-2/h3-11H,12H2,1-2H3/b10-6+