dimethyl 1-(2,6-dimethylphenyl)-1,2,4-triazole-3,5-dicarboxylate

Systemtic Name: dimethyl 1-(2,6-dimethylphenyl)-1,2,4-triazole-3,5-dicarboxylate Openeye Name: dimethyl 1-(2,6-dimethylphenyl)-1,2,4-triazole-3,5-dicarboxylate CAS Name: 1-(2,6-dimethylphenyl)-1,2,4-triazole-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-(2,6-dimethylphenyl)-1,2,4-triazole-3,5-dicarboxylate Traditional Name: 1-(2,6-dimethylphenyl)-1,2,4-triazole-3,5-dicarboxylic acid dimethyl ester Formula: C14H15N3O4 MolecularWeight: 289.2866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=NC(=N2)C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=NC(=N2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C14H15N3O4/c1-8-6-5-7-9(2)10(8)17-12(14(19)21-4)15-11(16-17)13(18)20-3/h5-7H,1-4H3