4-[(1-methylpyrazol-4-yl)carbamoyl]benzoic acid

Systemtic Name: 4-[(1-methylpyrazol-4-yl)carbamoyl]benzoic acid Openeye Name: 4-[(1-methylpyrazol-4-yl)carbamoyl]benzoic acid CAS Name: 4-[[(1-methyl-4-pyrazolyl)amino]-oxomethyl]benzoic acid IUPAC Name: 4-[(1-methylpyrazol-4-yl)carbamoyl]benzoic acid Traditional Name: 4-[(1-methylpyrazol-4-yl)carbamoyl]benzoic acid Formula: C12H11N3O3 MolecularWeight: 245.23404

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)NC(=O)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CN1C=C(C=N1)NC(=O)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C12H11N3O3/c1-15-7-10(6-13-15)14-11(16)8-2-4-9(5-3-8)12(17)18/h2-7H,1H3,(H,14,16)(H,17,18)