O3-[2-(4-benzamidophenyl)-2-oxidanylidene-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[2-(4-benzamidophenyl)-2-oxidanylidene-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-(4-benzamidophenyl)-2-oxo-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(4-benzamidophenyl)-2-oxoethyl] ester O1-methyl ester IUPAC Name: 3-O-[2-(4-benzamidophenyl)-2-oxoethyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(4-benzamidophenyl)-2-keto-ethyl] ester O1-methyl ester Formula: C24H18N2O8 MolecularWeight: 462.40832

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H18N2O8/c1-33-23(29)17-11-18(13-20(12-17)26(31)32)24(30)34-14-21(27)15-7-9-19(10-8-15)25-22(28)16-5-3-2-4-6-16/h2-13H,14H2,1H3,(H,25,28)