2-[[4-[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethoxy]carbonylphenyl]carbamoyl]benzoic acid

Systemtic Name: 2-[[4-[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethoxy]carbonylphenyl]carbamoyl]benzoic acid Openeye Name: 2-[[4-[2-(3-nitroanilino)-2-oxo-ethoxy]carbonylphenyl]carbamoyl]benzoic acid CAS Name: 2-[[4-[[2-(3-nitroanilino)-2-oxoethoxy]-oxomethyl]anilino]-oxomethyl]benzoic acid IUPAC Name: 2-[[4-[2-(3-nitroanilino)-2-oxoethoxy]carbonylphenyl]carbamoyl]benzoic acid Traditional Name: 2-[[4-[2-keto-2-(3-nitroanilino)ethoxy]carbonylphenyl]carbamoyl]benzoic acid Formula: C23H17N3O8 MolecularWeight: 463.39638

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)C(=O)OCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)C(=O)OCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C23H17N3O8/c27-20(24-16-4-3-5-17(12-16)26(32)33)13-34-23(31)14-8-10-15(11-9-14)25-21(28)18-6-1-2-7-19(18)22(29)30/h1-12H,13H2,(H,24,27)(H,25,28)(H,29,30)