(3-methylphenyl) 1-(5-chloranyl-2-methyl-phenyl)-5-methyl-1,2,3-triazole-4-carboxylate

Systemtic Name: (3-methylphenyl) 1-(5-chloranyl-2-methyl-phenyl)-5-methyl-1,2,3-triazole-4-carboxylate Openeye Name: m-tolyl 1-(5-chloro-2-methyl-phenyl)-5-methyl-triazole-4-carboxylate CAS Name: 1-(5-chloro-2-methylphenyl)-5-methyl-4-triazolecarboxylic acid (3-methylphenyl) ester IUPAC Name: (3-methylphenyl) 1-(5-chloro-2-methylphenyl)-5-methyltriazole-4-carboxylate Traditional Name: 1-(5-chloro-2-methyl-phenyl)-5-methyl-triazole-4-carboxylic acid m-tolyl ester Formula: C18H16ClN3O2 MolecularWeight: 341.79154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16ClN3O2/c1-11-5-4-6-15(9-11)24-18(23)17-13(3)22(21-20-17)16-10-14(19)8-7-12(16)2/h4-10H,1-3H3