1-[(4-tert-butylphenyl)methyl]-3,5-dimethyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-[(4-tert-butylphenyl)methyl]-3,5-dimethyl-pyrazole-4-carboxylic acid Openeye Name: 1-[(4-tert-butylphenyl)methyl]-3,5-dimethyl-pyrazole-4-carboxylic acid CAS Name: 1-[(4-tert-butylphenyl)methyl]-3,5-dimethyl-4-pyrazolecarboxylic acid IUPAC Name: 1-[(4-tert-butylphenyl)methyl]-3,5-dimethylpyrazole-4-carboxylic acid Traditional Name: 1-(4-tert-butylbenzyl)-3,5-dimethyl-pyrazole-4-carboxylic acid Formula: C17H22N2O2 MolecularWeight: 286.36878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(C)(C)C)C)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(C)(C)C)C)C(=O)O

InChI

InChI=1S/C17H22N2O2/c1-11-15(16(20)21)12(2)19(18-11)10-13-6-8-14(9-7-13)17(3,4)5/h6-9H,10H2,1-5H3,(H,20,21)