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

Systemtic Name: ethyl 1-[(3-chlorophenyl)methyl]-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 1-[(3-chlorophenyl)methyl]triazole-4-carboxylate CAS Name: 1-[(3-chlorophenyl)methyl]-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(3-chlorophenyl)methyl]triazole-4-carboxylate Traditional Name: 1-(3-chlorobenzyl)triazole-4-carboxylic acid ethyl ester Formula: C12H12ClN3O2 MolecularWeight: 265.69558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(N=N1)CC2=CC(=CC=C2)Cl

Isomeric SMILES

CCOC(=O)C1=CN(N=N1)CC2=CC(=CC=C2)Cl

InChI

InChI=1S/C12H12ClN3O2/c1-2-18-12(17)11-8-16(15-14-11)7-9-4-3-5-10(13)6-9/h3-6,8H,2,7H2,1H3