N-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethyl]-6-(propan-2-ylamino)pyridine-3-carboxamide

Systemtic Name: N-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethyl]-6-(propan-2-ylamino)pyridine-3-carboxamide Openeye Name: 6-(isopropylamino)-N-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethyl]pyridine-3-carboxamide CAS Name: N-[2-[(2R)-1-methyl-2-piperidin-1-iumyl]ethyl]-6-(propan-2-ylamino)-3-pyridinecarboxamide IUPAC Name: N-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethyl]-6-(propan-2-ylamino)pyridine-3-carboxamide Traditional Name: 6-(isopropylamino)-N-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethyl]nicotinamide Formula: C17H29N4O+ MolecularWeight: 305.43836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC=C(C=C1)C(=O)NCCC2CCCC[NH+]2C

Isomeric SMILES

CC(C)NC1=NC=C(C=C1)C(=O)NCC[C@H]2CCCC[NH+]2C

InChI

InChI=1S/C17H28N4O/c1-13(2)20-16-8-7-14(12-19-16)17(22)18-10-9-15-6-4-5-11-21(15)3/h7-8,12-13,15H,4-6,9-11H2,1-3H3,(H,18,22)(H,19,20)/p+1/t15-/m1/s1