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

Systemtic Name: methyl 4-[[4-methyl-3,5-bis(4-methylphenyl)pyrazol-1-yl]methyl]benzoate Openeye Name: methyl 4-[[4-methyl-3,5-bis(p-tolyl)pyrazol-1-yl]methyl]benzoate CAS Name: 4-[[4-methyl-3,5-bis(4-methylphenyl)-1-pyrazolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-methyl-3,5-bis(4-methylphenyl)pyrazol-1-yl]methyl]benzoate Traditional Name: 4-[[4-methyl-3,5-bis(p-tolyl)pyrazol-1-yl]methyl]benzoic acid methyl ester Formula: C27H26N2O2 MolecularWeight: 410.50754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H26N2O2/c1-18-5-11-22(12-6-18)25-20(3)26(23-13-7-19(2)8-14-23)29(28-25)17-21-9-15-24(16-10-21)27(30)31-4/h5-16H,17H2,1-4H3