N-[1-(1,3-benzodioxol-5-ylmethyl)piperidin-3-yl]-5-chloranyl-2-(2-propan-2-yloxyethylamino)pyridine-3-carboxamide

Systemtic Name: N-[1-(1,3-benzodioxol-5-ylmethyl)piperidin-3-yl]-5-chloranyl-2-(2-propan-2-yloxyethylamino)pyridine-3-carboxamide Openeye Name: N-[1-(1,3-benzodioxol-5-ylmethyl)-3-piperidyl]-5-chloro-2-(2-isopropoxyethylamino)pyridine-3-carboxamide CAS Name: N-[1-(1,3-benzodioxol-5-ylmethyl)-3-piperidinyl]-5-chloro-2-(2-propan-2-yloxyethylamino)-3-pyridinecarboxamide IUPAC Name: N-[1-(1,3-benzodioxol-5-ylmethyl)piperidin-3-yl]-5-chloro-2-(2-propan-2-yloxyethylamino)pyridine-3-carboxamide Traditional Name: 5-chloro-2-(2-isopropoxyethylamino)-N-(1-piperonyl-3-piperidyl)nicotinamide Formula: C24H31ClN4O4 MolecularWeight: 474.98034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCNC1=NC=C(C=C1C(=O)NC2CCCN(C2)CC3=CC4=C(C=C3)OCO4)Cl

Isomeric SMILES

CC(C)OCCNC1=NC=C(C=C1C(=O)NC2CCCN(C2)CC3=CC4=C(C=C3)OCO4)Cl

InChI

InChI=1S/C24H31ClN4O4/c1-16(2)31-9-7-26-23-20(11-18(25)12-27-23)24(30)28-19-4-3-8-29(14-19)13-17-5-6-21-22(10-17)33-15-32-21/h5-6,10-12,16,19H,3-4,7-9,13-15H2,1-2H3,(H,26,27)(H,28,30)