3-[[4-(4-nitrophenyl)-2,5-bis(oxidanylidene)pyrrol-3-yl]amino]benzoic acid

Systemtic Name: 3-[[4-(4-nitrophenyl)-2,5-bis(oxidanylidene)pyrrol-3-yl]amino]benzoic acid Openeye Name: 3-[[4-(4-nitrophenyl)-2,5-dioxo-pyrrol-3-yl]amino]benzoic acid CAS Name: 3-[[4-(4-nitrophenyl)-2,5-dioxo-3-pyrrolyl]amino]benzoic acid IUPAC Name: 3-[[4-(4-nitrophenyl)-2,5-dioxopyrrol-3-yl]amino]benzoic acid Traditional Name: 3-[[2,5-diketo-4-(4-nitrophenyl)-3-pyrrolin-3-yl]amino]benzoic acid Formula: C17H11N3O6 MolecularWeight: 353.28574

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H11N3O6/c21-15-13(9-4-6-12(7-5-9)20(25)26)14(16(22)19-15)18-11-3-1-2-10(8-11)17(23)24/h1-8H,(H,23,24)(H2,18,19,21,22)