1-(3-methylphenyl)-3,5-di(propan-2-yl)pyrazole-4-carboxylic acid

Systemtic Name: 1-(3-methylphenyl)-3,5-di(propan-2-yl)pyrazole-4-carboxylic acid Openeye Name: 3,5-diisopropyl-1-(m-tolyl)pyrazole-4-carboxylic acid CAS Name: 1-(3-methylphenyl)-3,5-di(propan-2-yl)-4-pyrazolecarboxylic acid IUPAC Name: 1-(3-methylphenyl)-3,5-di(propan-2-yl)pyrazole-4-carboxylic acid Traditional Name: 3,5-diisopropyl-1-(m-tolyl)pyrazole-4-carboxylic acid Formula: C17H22N2O2 MolecularWeight: 286.36878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C(C(=N2)C(C)C)C(=O)O)C(C)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C(C(=N2)C(C)C)C(=O)O)C(C)C

InChI

InChI=1S/C17H22N2O2/c1-10(2)15-14(17(20)21)16(11(3)4)19(18-15)13-8-6-7-12(5)9-13/h6-11H,1-5H3,(H,20,21)