1-[1-(1,3-benzodioxol-5-ylcarbonyl)piperidin-4-yl]-N-(2-methylpropyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-[1-(1,3-benzodioxol-5-ylcarbonyl)piperidin-4-yl]-N-(2-methylpropyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-[1-(1,3-benzodioxole-5-carbonyl)-4-piperidyl]-N-isobutyl-triazole-4-carboxamide CAS Name: 1-[1-[1,3-benzodioxol-5-yl(oxo)methyl]-4-piperidinyl]-N-(2-methylpropyl)-4-triazolecarboxamide IUPAC Name: 1-[1-(1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-N-(2-methylpropyl)triazole-4-carboxamide Traditional Name: N-isobutyl-1-(1-piperonyloyl-4-piperidyl)triazole-4-carboxamide Formula: C20H25N5O4 MolecularWeight: 399.4436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CN(N=N1)C2CCN(CC2)C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)CNC(=O)C1=CN(N=N1)C2CCN(CC2)C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H25N5O4/c1-13(2)10-21-19(26)16-11-25(23-22-16)15-5-7-24(8-6-15)20(27)14-3-4-17-18(9-14)29-12-28-17/h3-4,9,11,13,15H,5-8,10,12H2,1-2H3,(H,21,26)