N-(3-methylbutyl)-1-(2-methylpropyl)-4-oxidanylidene-5-(4-propan-2-ylpiperazin-4-ium-1-yl)carbonyl-pyridine-3-carboxamide

Systemtic Name: N-(3-methylbutyl)-1-(2-methylpropyl)-4-oxidanylidene-5-(4-propan-2-ylpiperazin-4-ium-1-yl)carbonyl-pyridine-3-carboxamide Openeye Name: 1-isobutyl-N-isopentyl-5-(4-isopropylpiperazin-4-ium-1-carbonyl)-4-oxo-pyridine-3-carboxamide CAS Name: N-(3-methylbutyl)-1-(2-methylpropyl)-4-oxo-5-[oxo-(4-propan-2-yl-1-piperazin-4-iumyl)methyl]-3-pyridinecarboxamide IUPAC Name: N-(3-methylbutyl)-1-(2-methylpropyl)-4-oxo-5-(4-propan-2-ylpiperazin-4-ium-1-carbonyl)pyridine-3-carboxamide Traditional Name: N-isoamyl-1-isobutyl-5-(4-isopropylpiperazin-4-ium-1-carbonyl)-4-keto-nicotinamide Formula: C23H39N4O3+ MolecularWeight: 419.58076

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H38N4O3/c1-16(2)7-8-24-22(29)19-14-25(13-17(3)4)15-20(21(19)28)23(30)27-11-9-26(10-12-27)18(5)6/h14-18H,7-13H2,1-6H3,(H,24,29)/p+1