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

Systemtic Name: 1-(3,5-dimethylphenyl)-5-propan-2-yl-pyrazole-4-carboxylic acid Openeye Name: 1-(3,5-dimethylphenyl)-5-isopropyl-pyrazole-4-carboxylic acid CAS Name: 1-(3,5-dimethylphenyl)-5-propan-2-yl-4-pyrazolecarboxylic acid IUPAC Name: 1-(3,5-dimethylphenyl)-5-propan-2-ylpyrazole-4-carboxylic acid Traditional Name: 1-(3,5-dimethylphenyl)-5-isopropyl-pyrazole-4-carboxylic acid Formula: C15H18N2O2 MolecularWeight: 258.31562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N2O2/c1-9(2)14-13(15(18)19)8-16-17(14)12-6-10(3)5-11(4)7-12/h5-9H,1-4H3,(H,18,19)