2-[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]ethanoate

Systemtic Name: 2-[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]ethanoate Openeye Name: 2-[3,5-dimethyl-1-(p-tolyl)pyrazol-4-yl]acetate CAS Name: 2-[3,5-dimethyl-1-(4-methylphenyl)-4-pyrazolyl]acetate IUPAC Name: 2-[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]acetate Traditional Name: 2-[3,5-dimethyl-1-(p-tolyl)pyrazol-4-yl]acetate Formula: C14H15N2O2- MolecularWeight: 243.2811

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)CC(=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)CC(=O)[O-])C

InChI

InChI=1S/C14H16N2O2/c1-9-4-6-12(7-5-9)16-11(3)13(8-14(17)18)10(2)15-16/h4-7H,8H2,1-3H3,(H,17,18)/p-1