N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide Openeye Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-(5-cyano-2-pyridyl)piperidine-4-carboxamide CAS Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-(5-cyano-2-pyridinyl)-4-piperidinecarboxamide IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide Traditional Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-(5-cyano-2-pyridyl)isonipecotamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC(=O)C3CCN(CC3)C4=NC=C(C=C4)C#N

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCO2)NC(=O)C3CCN(CC3)C4=NC=C(C=C4)C#N

InChI

InChI=1S/C21H22N4O3/c1-14(17-3-4-18-19(10-17)28-13-27-18)24-21(26)16-6-8-25(9-7-16)20-5-2-15(11-22)12-23-20/h2-5,10,12,14,16H,6-9,13H2,1H3,(H,24,26)