methyl 3-[[3,5-bis(4-methylphenyl)pyrazol-1-yl]methyl]benzoate

Systemtic Name: methyl 3-[[3,5-bis(4-methylphenyl)pyrazol-1-yl]methyl]benzoate Openeye Name: methyl 3-[[3,5-bis(p-tolyl)pyrazol-1-yl]methyl]benzoate CAS Name: 3-[[3,5-bis(4-methylphenyl)-1-pyrazolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[3,5-bis(4-methylphenyl)pyrazol-1-yl]methyl]benzoate Traditional Name: 3-[[3,5-bis(p-tolyl)pyrazol-1-yl]methyl]benzoic acid methyl ester Formula: C26H24N2O2 MolecularWeight: 396.48096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NN2CC3=CC=CC(=C3)C(=O)OC)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NN2CC3=CC=CC(=C3)C(=O)OC)C4=CC=C(C=C4)C

InChI

InChI=1S/C26H24N2O2/c1-18-7-11-21(12-8-18)24-16-25(22-13-9-19(2)10-14-22)28(27-24)17-20-5-4-6-23(15-20)26(29)30-3/h4-16H,17H2,1-3H3