3-methyl-5-[methyl(2-methylpropyl)amino]-1-phenyl-pyrazole-4-carboxylic acid

Systemtic Name: 3-methyl-5-[methyl(2-methylpropyl)amino]-1-phenyl-pyrazole-4-carboxylic acid Openeye Name: 5-[isobutyl(methyl)amino]-3-methyl-1-phenyl-pyrazole-4-carboxylic acid CAS Name: 3-methyl-5-[methyl(2-methylpropyl)amino]-1-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 3-methyl-5-[methyl(2-methylpropyl)amino]-1-phenylpyrazole-4-carboxylic acid Traditional Name: 5-[isobutyl(methyl)amino]-3-methyl-1-phenyl-pyrazole-4-carboxylic acid Formula: C16H21N3O2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)O)N(C)CC(C)C)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=C1C(=O)O)N(C)CC(C)C)C2=CC=CC=C2

InChI

InChI=1S/C16H21N3O2/c1-11(2)10-18(4)15-14(16(20)21)12(3)17-19(15)13-8-6-5-7-9-13/h5-9,11H,10H2,1-4H3,(H,20,21)