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

Systemtic Name: 2-chloranyl-5-[[4-(3-nitrophenyl)-2,5-bis(oxidanylidene)pyrrol-3-yl]amino]benzoic acid Openeye Name: 2-chloro-5-[[4-(3-nitrophenyl)-2,5-dioxo-pyrrol-3-yl]amino]benzoic acid CAS Name: 2-chloro-5-[[4-(3-nitrophenyl)-2,5-dioxo-3-pyrrolyl]amino]benzoic acid IUPAC Name: 2-chloro-5-[[4-(3-nitrophenyl)-2,5-dioxopyrrol-3-yl]amino]benzoic acid Traditional Name: 2-chloro-5-[[2,5-diketo-4-(3-nitrophenyl)-3-pyrrolin-3-yl]amino]benzoic acid Formula: C17H10ClN3O6 MolecularWeight: 387.7308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H10ClN3O6/c18-12-5-4-9(7-11(12)17(24)25)19-14-13(15(22)20-16(14)23)8-2-1-3-10(6-8)21(26)27/h1-7H,(H,24,25)(H2,19,20,22,23)