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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C=C(C(=O)C(=C1)C(=O)N2CC[NH+](CC2)CCOC)C(=O)NC(C)(C)C

Isomeric SMILES

CC(C)CCN1C=C(C(=O)C(=C1)C(=O)N2CC[NH+](CC2)CCOC)C(=O)NC(C)(C)C

InChI

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