5-[4-(2-methoxyethyl)piperazin-4-ium-1-yl]carbonyl-N-(3-methylbutyl)-1-(2-methylpropyl)-4-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: 5-[4-(2-methoxyethyl)piperazin-4-ium-1-yl]carbonyl-N-(3-methylbutyl)-1-(2-methylpropyl)-4-oxidanylidene-pyridine-3-carboxamide Openeye Name: 1-isobutyl-N-isopentyl-5-[4-(2-methoxyethyl)piperazin-4-ium-1-carbonyl]-4-oxo-pyridine-3-carboxamide CAS Name: 5-[[4-(2-methoxyethyl)-1-piperazin-4-iumyl]-oxomethyl]-N-(3-methylbutyl)-1-(2-methylpropyl)-4-oxo-3-pyridinecarboxamide IUPAC Name: 5-[4-(2-methoxyethyl)piperazin-4-ium-1-carbonyl]-N-(3-methylbutyl)-1-(2-methylpropyl)-4-oxopyridine-3-carboxamide Traditional Name: N-isoamyl-1-isobutyl-4-keto-5-[4-(2-methoxyethyl)piperazin-4-ium-1-carbonyl]nicotinamide Formula: C23H39N4O4+ MolecularWeight: 435.58016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CC[NH+](CC2)CCOC)CC(C)C

Isomeric SMILES

CC(C)CCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CC[NH+](CC2)CCOC)CC(C)C

InChI

InChI=1S/C23H38N4O4/c1-17(2)6-7-24-22(29)19-15-26(14-18(3)4)16-20(21(19)28)23(30)27-10-8-25(9-11-27)12-13-31-5/h15-18H,6-14H2,1-5H3,(H,24,29)/p+1