3-methyl-4-[[1-(phenylmethyl)pyrazol-4-yl]carbonylamino]benzoic acid

Systemtic Name: 3-methyl-4-[[1-(phenylmethyl)pyrazol-4-yl]carbonylamino]benzoic acid Openeye Name: 4-[(1-benzylpyrazole-4-carbonyl)amino]-3-methyl-benzoic acid CAS Name: 3-methyl-4-[[oxo-[1-(phenylmethyl)-4-pyrazolyl]methyl]amino]benzoic acid IUPAC Name: 4-[(1-benzylpyrazole-4-carbonyl)amino]-3-methylbenzoic acid Traditional Name: 4-[(1-benzylpyrazole-4-carbonyl)amino]-3-methyl-benzoic acid Formula: C19H17N3O3 MolecularWeight: 335.35658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2=CN(N=C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2=CN(N=C2)CC3=CC=CC=C3

InChI

InChI=1S/C19H17N3O3/c1-13-9-15(19(24)25)7-8-17(13)21-18(23)16-10-20-22(12-16)11-14-5-3-2-4-6-14/h2-10,12H,11H2,1H3,(H,21,23)(H,24,25)