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

Systemtic Name: 1-[2-[1-(1,3-benzodioxol-5-ylcarbonyl)piperidin-2-yl]ethyl]-N-propan-2-yl-1,2,3-triazole-4-carboxamide Openeye Name: 1-[2-[1-(1,3-benzodioxole-5-carbonyl)-2-piperidyl]ethyl]-N-isopropyl-triazole-4-carboxamide CAS Name: 1-[2-[1-[1,3-benzodioxol-5-yl(oxo)methyl]-2-piperidinyl]ethyl]-N-propan-2-yl-4-triazolecarboxamide IUPAC Name: 1-[2-[1-(1,3-benzodioxole-5-carbonyl)piperidin-2-yl]ethyl]-N-propan-2-yltriazole-4-carboxamide Traditional Name: N-isopropyl-1-[2-(1-piperonyloyl-2-piperidyl)ethyl]triazole-4-carboxamide Formula: C21H27N5O4 MolecularWeight: 413.47018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CN(N=N1)CCC2CCCCN2C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)NC(=O)C1=CN(N=N1)CCC2CCCCN2C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H27N5O4/c1-14(2)22-20(27)17-12-25(24-23-17)10-8-16-5-3-4-9-26(16)21(28)15-6-7-18-19(11-15)30-13-29-18/h6-7,11-12,14,16H,3-5,8-10,13H2,1-2H3,(H,22,27)