N3-cyclopentyl-1-(3-methylbutyl)-N5-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-4-oxidanylidene-pyridine-3,5-dicarboxamide

Systemtic Name: N3-cyclopentyl-1-(3-methylbutyl)-N5-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-4-oxidanylidene-pyridine-3,5-dicarboxamide Openeye Name: N3-cyclopentyl-1-isopentyl-N5-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-4-oxo-pyridine-3,5-dicarboxamide CAS Name: N3-cyclopentyl-1-(3-methylbutyl)-N5-[[(3R)-1-methyl-3-piperidin-1-iumyl]methyl]-4-oxopyridine-3,5-dicarboxamide IUPAC Name: 3-N-cyclopentyl-1-(3-methylbutyl)-5-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-4-oxopyridine-3,5-dicarboxamide Traditional Name: N-cyclopentyl-1-isoamyl-4-keto-N'-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]dinicotinamide Formula: C24H39N4O3+ MolecularWeight: 431.59146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C=C(C(=O)C(=C1)C(=O)NC2CCCC2)C(=O)NCC3CCC[NH+](C3)C

Isomeric SMILES

CC(C)CCN1C=C(C(=O)C(=C1)C(=O)NC2CCCC2)C(=O)NC[C@H]3CCC[NH+](C3)C

InChI

InChI=1S/C24H38N4O3/c1-17(2)10-12-28-15-20(23(30)25-13-18-7-6-11-27(3)14-18)22(29)21(16-28)24(31)26-19-8-4-5-9-19/h15-19H,4-14H2,1-3H3,(H,25,30)(H,26,31)/p+1/t18-/m1/s1