3-[1-(4-propan-2-ylphenyl)pyrazol-3-yl]benzoic acid

Systemtic Name: 3-[1-(4-propan-2-ylphenyl)pyrazol-3-yl]benzoic acid Openeye Name: 3-[1-(4-isopropylphenyl)pyrazol-3-yl]benzoic acid CAS Name: 3-[1-(4-propan-2-ylphenyl)-3-pyrazolyl]benzoic acid IUPAC Name: 3-[1-(4-propan-2-ylphenyl)pyrazol-3-yl]benzoic acid Traditional Name: 3-(1-p-cumenylpyrazol-3-yl)benzoic acid Formula: C19H18N2O2 MolecularWeight: 306.35842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C=CC(=N2)C3=CC(=CC=C3)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C=CC(=N2)C3=CC(=CC=C3)C(=O)O

InChI

InChI=1S/C19H18N2O2/c1-13(2)14-6-8-17(9-7-14)21-11-10-18(20-21)15-4-3-5-16(12-15)19(22)23/h3-13H,1-2H3,(H,22,23)