4-[[1-methyl-2,5-bis(oxidanylidene)pyrrol-3-yl]amino]benzoic acid

Systemtic Name: 4-[[1-methyl-2,5-bis(oxidanylidene)pyrrol-3-yl]amino]benzoic acid Openeye Name: 4-[(1-methyl-2,5-dioxo-pyrrol-3-yl)amino]benzoic acid CAS Name: 4-[(1-methyl-2,5-dioxo-3-pyrrolyl)amino]benzoic acid IUPAC Name: 4-[(1-methyl-2,5-dioxopyrrol-3-yl)amino]benzoic acid Traditional Name: 4-[(2,5-diketo-1-methyl-3-pyrrolin-3-yl)amino]benzoic acid Formula: C12H10N2O4 MolecularWeight: 246.2188

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(C1=O)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CN1C(=O)C=C(C1=O)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C12H10N2O4/c1-14-10(15)6-9(11(14)16)13-8-4-2-7(3-5-8)12(17)18/h2-6,13H,1H3,(H,17,18)