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

Systemtic Name: N-(3-methylbutyl)-1-(2-methylpropyl)-4-oxidanylidene-5-(4-piperidin-1-ium-1-ylpiperidin-1-yl)carbonyl-pyridine-3-carboxamide Openeye Name: 1-isobutyl-N-isopentyl-4-oxo-5-(4-piperidin-1-ium-1-ylpiperidine-1-carbonyl)pyridine-3-carboxamide CAS Name: N-(3-methylbutyl)-1-(2-methylpropyl)-4-oxo-5-[oxo-[4-(1-piperidin-1-iumyl)-1-piperidinyl]methyl]-3-pyridinecarboxamide IUPAC Name: N-(3-methylbutyl)-1-(2-methylpropyl)-4-oxo-5-(4-piperidin-1-ium-1-ylpiperidine-1-carbonyl)pyridine-3-carboxamide Traditional Name: N-isoamyl-1-isobutyl-4-keto-5-(4-piperidin-1-ium-1-ylpiperidine-1-carbonyl)nicotinamide Formula: C26H43N4O3+ MolecularWeight: 459.64462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CCC(CC2)[NH+]3CCCCC3)CC(C)C

Isomeric SMILES

CC(C)CCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CCC(CC2)[NH+]3CCCCC3)CC(C)C

InChI

InChI=1S/C26H42N4O3/c1-19(2)8-11-27-25(32)22-17-28(16-20(3)4)18-23(24(22)31)26(33)30-14-9-21(10-15-30)29-12-6-5-7-13-29/h17-21H,5-16H2,1-4H3,(H,27,32)/p+1