2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-N-[3-[(3S)-3-methylpiperidin-1-ium-1-yl]propyl]pyridine-3-carboxamide

Systemtic Name: 2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-N-[3-[(3S)-3-methylpiperidin-1-ium-1-yl]propyl]pyridine-3-carboxamide Openeye Name: 2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-[3-[(3S)-3-methylpiperidin-1-ium-1-yl]propyl]pyridine-3-carboxamide CAS Name: 2-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-N-[3-[(3S)-3-methyl-1-piperidin-1-iumyl]propyl]-3-pyridinecarboxamide IUPAC Name: 2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-[3-[(3S)-3-methylpiperidin-1-ium-1-yl]propyl]pyridine-3-carboxamide Traditional Name: 2-[4-(2-furoyl)piperazino]-N-[3-[(3S)-3-methylpiperidin-1-ium-1-yl]propyl]nicotinamide Formula: C24H34N5O3+ MolecularWeight: 440.55846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCCNC(=O)C2=C(N=CC=C2)N3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CCCNC(=O)C2=C(N=CC=C2)N3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C24H33N5O3/c1-19-6-3-11-27(18-19)12-5-10-26-23(30)20-7-2-9-25-22(20)28-13-15-29(16-14-28)24(31)21-8-4-17-32-21/h2,4,7-9,17,19H,3,5-6,10-16,18H2,1H3,(H,26,30)/p+1/t19-/m0/s1