1-methyl-4-[(phenylmethyl)carbamoyl]pyrazole-3-carboxylic acid

Systemtic Name: 1-methyl-4-[(phenylmethyl)carbamoyl]pyrazole-3-carboxylic acid Openeye Name: 4-(benzylcarbamoyl)-1-methyl-pyrazole-3-carboxylic acid CAS Name: 1-methyl-4-[oxo-[(phenylmethyl)amino]methyl]-3-pyrazolecarboxylic acid IUPAC Name: 4-(benzylcarbamoyl)-1-methylpyrazole-3-carboxylic acid Traditional Name: 4-(benzylcarbamoyl)-1-methyl-pyrazole-3-carboxylic acid Formula: C13H13N3O3 MolecularWeight: 259.26062

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)O)C(=O)NCC2=CC=CC=C2

Isomeric SMILES

CN1C=C(C(=N1)C(=O)O)C(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C13H13N3O3/c1-16-8-10(11(15-16)13(18)19)12(17)14-7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,14,17)(H,18,19)