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

Systemtic Name: methyl 4-[4,4-dimethyl-5-(4-methylphenyl)pyrazol-3-yl]benzoate Openeye Name: methyl 4-[4,4-dimethyl-5-(p-tolyl)pyrazol-3-yl]benzoate CAS Name: 4-[4,4-dimethyl-5-(4-methylphenyl)-3-pyrazolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4,4-dimethyl-5-(4-methylphenyl)pyrazol-3-yl]benzoate Traditional Name: 4-[4,4-dimethyl-5-(p-tolyl)pyrazol-3-yl]benzoic acid methyl ester Formula: C20H20N2O2 MolecularWeight: 320.385

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(C2(C)C)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(C2(C)C)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H20N2O2/c1-13-5-7-14(8-6-13)17-20(2,3)18(22-21-17)15-9-11-16(12-10-15)19(23)24-4/h5-12H,1-4H3