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

Systemtic Name: (phenylmethyl) 1-(3-chloranyl-4-methoxy-phenyl)-5-methyl-1,2,3-triazole-4-carboxylate Openeye Name: benzyl 1-(3-chloro-4-methoxy-phenyl)-5-methyl-triazole-4-carboxylate CAS Name: 1-(3-chloro-4-methoxyphenyl)-5-methyl-4-triazolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-(3-chloro-4-methoxyphenyl)-5-methyltriazole-4-carboxylate Traditional Name: 1-(3-chloro-4-methoxy-phenyl)-5-methyl-triazole-4-carboxylic acid benzyl ester Formula: C18H16ClN3O3 MolecularWeight: 357.79094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1C2=CC(=C(C=C2)OC)Cl)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(N=NN1C2=CC(=C(C=C2)OC)Cl)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C18H16ClN3O3/c1-12-17(18(23)25-11-13-6-4-3-5-7-13)20-21-22(12)14-8-9-16(24-2)15(19)10-14/h3-10H,11H2,1-2H3