[2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 2-[2-(3,4-dimethylphenoxy)ethanoylamino]benzoate

Systemtic Name: [2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 2-[2-(3,4-dimethylphenoxy)ethanoylamino]benzoate Openeye Name: [2-(3-nitrophenyl)-2-oxo-ethyl] 2-[[2-(3,4-dimethylphenoxy)acetyl]amino]benzoate CAS Name: 2-[[2-(3,4-dimethylphenoxy)-1-oxoethyl]amino]benzoic acid [2-(3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-nitrophenyl)-2-oxoethyl] 2-[[2-(3,4-dimethylphenoxy)acetyl]amino]benzoate Traditional Name: 2-[[2-(3,4-dimethylphenoxy)acetyl]amino]benzoic acid [2-keto-2-(3-nitrophenyl)ethyl] ester Formula: C25H22N2O7 MolecularWeight: 462.45138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC(=O)NC2=CC=CC=C2C(=O)OCC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC(=O)NC2=CC=CC=C2C(=O)OCC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C25H22N2O7/c1-16-10-11-20(12-17(16)2)33-15-24(29)26-22-9-4-3-8-21(22)25(30)34-14-23(28)18-6-5-7-19(13-18)27(31)32/h3-13H,14-15H2,1-2H3,(H,26,29)