2-(2,4-dimethylphenyl)-N-(6-ethanoyl-1,3-benzodioxol-5-yl)-5-methyl-1,2,3-triazole-4-carboxamide

Systemtic Name: 2-(2,4-dimethylphenyl)-N-(6-ethanoyl-1,3-benzodioxol-5-yl)-5-methyl-1,2,3-triazole-4-carboxamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(2,4-dimethylphenyl)-5-methyl-triazole-4-carboxamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(2,4-dimethylphenyl)-5-methyl-4-triazolecarboxamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(2,4-dimethylphenyl)-5-methyltriazole-4-carboxamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(2,4-dimethylphenyl)-5-methyl-triazole-4-carboxamide Formula: C21H20N4O4 MolecularWeight: 392.4079

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2N=C(C(=N2)C(=O)NC3=CC4=C(C=C3C(=O)C)OCO4)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2N=C(C(=N2)C(=O)NC3=CC4=C(C=C3C(=O)C)OCO4)C)C

InChI

InChI=1S/C21H20N4O4/c1-11-5-6-17(12(2)7-11)25-23-13(3)20(24-25)21(27)22-16-9-19-18(28-10-29-19)8-15(16)14(4)26/h5-9H,10H2,1-4H3,(H,22,27)