diethyl 1-[(2,4,6-trimethylphenyl)methyl]-1,2,3-triazole-4,5-dicarboxylate

Systemtic Name: diethyl 1-[(2,4,6-trimethylphenyl)methyl]-1,2,3-triazole-4,5-dicarboxylate Openeye Name: diethyl 1-[(2,4,6-trimethylphenyl)methyl]triazole-4,5-dicarboxylate CAS Name: 1-[(2,4,6-trimethylphenyl)methyl]triazole-4,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1-[(2,4,6-trimethylphenyl)methyl]triazole-4,5-dicarboxylate Traditional Name: 1-(2,4,6-trimethylbenzyl)triazole-4,5-dicarboxylic acid diethyl ester Formula: C18H23N3O4 MolecularWeight: 345.39292

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=N1)CC2=C(C=C(C=C2C)C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(N(N=N1)CC2=C(C=C(C=C2C)C)C)C(=O)OCC

InChI

InChI=1S/C18H23N3O4/c1-6-24-17(22)15-16(18(23)25-7-2)21(20-19-15)10-14-12(4)8-11(3)9-13(14)5/h8-9H,6-7,10H2,1-5H3