1,3-benzodioxol-5-yl 2-(2,4-dimethylphenyl)-5-methyl-1,2,3-triazole-4-carboxylate

Systemtic Name: 1,3-benzodioxol-5-yl 2-(2,4-dimethylphenyl)-5-methyl-1,2,3-triazole-4-carboxylate Openeye Name: 1,3-benzodioxol-5-yl 2-(2,4-dimethylphenyl)-5-methyl-triazole-4-carboxylate CAS Name: 2-(2,4-dimethylphenyl)-5-methyl-4-triazolecarboxylic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 2-(2,4-dimethylphenyl)-5-methyltriazole-4-carboxylate Traditional Name: 2-(2,4-dimethylphenyl)-5-methyl-triazole-4-carboxylic acid 1,3-benzodioxol-5-yl ester Formula: C19H17N3O4 MolecularWeight: 351.35598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2N=C(C(=N2)C(=O)OC3=CC4=C(C=C3)OCO4)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2N=C(C(=N2)C(=O)OC3=CC4=C(C=C3)OCO4)C)C

InChI

InChI=1S/C19H17N3O4/c1-11-4-6-15(12(2)8-11)22-20-13(3)18(21-22)19(23)26-14-5-7-16-17(9-14)25-10-24-16/h4-9H,10H2,1-3H3