diethyl 1-[(4-methylphenyl)methyl]-1,2,3-triazole-4,5-dicarboxylate

Systemtic Name: diethyl 1-[(4-methylphenyl)methyl]-1,2,3-triazole-4,5-dicarboxylate Openeye Name: diethyl 1-(p-tolylmethyl)triazole-4,5-dicarboxylate CAS Name: 1-[(4-methylphenyl)methyl]triazole-4,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1-[(4-methylphenyl)methyl]triazole-4,5-dicarboxylate Traditional Name: 1-(4-methylbenzyl)triazole-4,5-dicarboxylic acid diethyl ester Formula: C16H19N3O4 MolecularWeight: 317.33976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=N1)CC2=CC=C(C=C2)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(N(N=N1)CC2=CC=C(C=C2)C)C(=O)OCC

InChI

InChI=1S/C16H19N3O4/c1-4-22-15(20)13-14(16(21)23-5-2)19(18-17-13)10-12-8-6-11(3)7-9-12/h6-9H,4-5,10H2,1-3H3