3-[(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonylamino]benzoic acid

Systemtic Name: 3-[(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonylamino]benzoic acid Openeye Name: 3-[(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)amino]benzoic acid CAS Name: 3-[[(5-tert-butyl-2-methyl-3-pyrazolyl)-oxomethyl]amino]benzoic acid IUPAC Name: 3-[(5-tert-butyl-2-methylpyrazole-3-carbonyl)amino]benzoic acid Traditional Name: 3-[(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)amino]benzoic acid Formula: C16H19N3O3 MolecularWeight: 301.34036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O3/c1-16(2,3)13-9-12(19(4)18-13)14(20)17-11-7-5-6-10(8-11)15(21)22/h5-9H,1-4H3,(H,17,20)(H,21,22)