(3,4-dimethylphenyl) 4-pyrazol-1-ylbenzoate

Systemtic Name: (3,4-dimethylphenyl) 4-pyrazol-1-ylbenzoate Openeye Name: (3,4-dimethylphenyl) 4-pyrazol-1-ylbenzoate CAS Name: 4-(1-pyrazolyl)benzoic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) 4-pyrazol-1-ylbenzoate Traditional Name: 4-pyrazol-1-ylbenzoic acid (3,4-dimethylphenyl) ester Formula: C18H16N2O2 MolecularWeight: 292.33184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(=O)C2=CC=C(C=C2)N3C=CC=N3)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC(=O)C2=CC=C(C=C2)N3C=CC=N3)C

InChI

InChI=1S/C18H16N2O2/c1-13-4-9-17(12-14(13)2)22-18(21)15-5-7-16(8-6-15)20-11-3-10-19-20/h3-12H,1-2H3