(3-methylphenyl) 5-methyl-1-(4-propan-2-ylphenyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: (3-methylphenyl) 5-methyl-1-(4-propan-2-ylphenyl)-1,2,3-triazole-4-carboxylate Openeye Name: m-tolyl 1-(4-isopropylphenyl)-5-methyl-triazole-4-carboxylate CAS Name: 5-methyl-1-(4-propan-2-ylphenyl)-4-triazolecarboxylic acid (3-methylphenyl) ester IUPAC Name: (3-methylphenyl) 5-methyl-1-(4-propan-2-ylphenyl)triazole-4-carboxylate Traditional Name: 5-methyl-1-p-cumenyl-triazole-4-carboxylic acid m-tolyl ester Formula: C20H21N3O2 MolecularWeight: 335.39964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(=O)C2=C(N(N=N2)C3=CC=C(C=C3)C(C)C)C

Isomeric SMILES

CC1=CC(=CC=C1)OC(=O)C2=C(N(N=N2)C3=CC=C(C=C3)C(C)C)C

InChI

InChI=1S/C20H21N3O2/c1-13(2)16-8-10-17(11-9-16)23-15(4)19(21-22-23)20(24)25-18-7-5-6-14(3)12-18/h5-13H,1-4H3