3-[(2-azanyl-3-oxidanylidene-1H-pyrazol-5-yl)carbamoyl]benzoic acid

Systemtic Name: 3-[(2-azanyl-3-oxidanylidene-1H-pyrazol-5-yl)carbamoyl]benzoic acid Openeye Name: 3-[(2-amino-3-oxo-1H-pyrazol-5-yl)carbamoyl]benzoic acid CAS Name: 3-[[(2-amino-3-oxo-1H-pyrazol-5-yl)amino]-oxomethyl]benzoic acid IUPAC Name: 3-[(2-amino-3-oxo-1H-pyrazol-5-yl)carbamoyl]benzoic acid Traditional Name: 3-[(1-amino-5-keto-3-pyrazolin-3-yl)carbamoyl]benzoic acid Formula: C11H10N4O4 MolecularWeight: 262.2215

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)O)C(=O)NC2=CC(=O)N(N2)N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)O)C(=O)NC2=CC(=O)N(N2)N

InChI

InChI=1S/C11H10N4O4/c12-15-9(16)5-8(14-15)13-10(17)6-2-1-3-7(4-6)11(18)19/h1-5,14H,12H2,(H,13,17)(H,18,19)