[2-(4-benzamidophenyl)-2-oxidanylidene-ethyl] 5-ethoxy-4-methoxy-2-nitro-benzoate

Systemtic Name: [2-(4-benzamidophenyl)-2-oxidanylidene-ethyl] 5-ethoxy-4-methoxy-2-nitro-benzoate Openeye Name: [2-(4-benzamidophenyl)-2-oxo-ethyl] 5-ethoxy-4-methoxy-2-nitro-benzoate CAS Name: 5-ethoxy-4-methoxy-2-nitrobenzoic acid [2-(4-benzamidophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-benzamidophenyl)-2-oxoethyl] 5-ethoxy-4-methoxy-2-nitrobenzoate Traditional Name: 5-ethoxy-4-methoxy-2-nitro-benzoic acid [2-(4-benzamidophenyl)-2-keto-ethyl] ester Formula: C25H22N2O8 MolecularWeight: 478.45078

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)OCC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)OCC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C25H22N2O8/c1-3-34-23-13-19(20(27(31)32)14-22(23)33-2)25(30)35-15-21(28)16-9-11-18(12-10-16)26-24(29)17-7-5-4-6-8-17/h4-14H,3,15H2,1-2H3,(H,26,29)