methyl 1-[(2-methylphenyl)methyl]-1,2,3-triazole-4-carboxylate

Systemtic Name: methyl 1-[(2-methylphenyl)methyl]-1,2,3-triazole-4-carboxylate Openeye Name: methyl 1-(o-tolylmethyl)triazole-4-carboxylate CAS Name: 1-[(2-methylphenyl)methyl]-4-triazolecarboxylic acid methyl ester IUPAC Name: methyl 1-[(2-methylphenyl)methyl]triazole-4-carboxylate Traditional Name: 1-(2-methylbenzyl)triazole-4-carboxylic acid methyl ester Formula: C12H13N3O2 MolecularWeight: 231.25052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=C(N=N2)C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1CN2C=C(N=N2)C(=O)OC

InChI

InChI=1S/C12H13N3O2/c1-9-5-3-4-6-10(9)7-15-8-11(13-14-15)12(16)17-2/h3-6,8H,7H2,1-2H3