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

Systemtic Name: N5-butyl-1-cyclohexyl-N3-methyl-N3-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-4-oxidanylidene-pyridine-3,5-dicarboxamide Openeye Name: N5-butyl-1-cyclohexyl-N3-methyl-N3-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-4-oxo-pyridine-3,5-dicarboxamide CAS Name: N5-butyl-1-cyclohexyl-N3-methyl-N3-[[(3R)-1-methyl-3-piperidin-1-iumyl]methyl]-4-oxopyridine-3,5-dicarboxamide IUPAC Name: 5-N-butyl-1-cyclohexyl-3-N-methyl-3-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-4-oxopyridine-3,5-dicarboxamide Traditional Name: N'-butyl-1-cyclohexyl-4-keto-N-methyl-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]dinicotinamide Formula: C25H41N4O3+ MolecularWeight: 445.61804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CN(C=C(C1=O)C(=O)N(C)CC2CCC[NH+](C2)C)C3CCCCC3

Isomeric SMILES

CCCCNC(=O)C1=CN(C=C(C1=O)C(=O)N(C)C[C@H]2CCC[NH+](C2)C)C3CCCCC3

InChI

InChI=1S/C25H40N4O3/c1-4-5-13-26-24(31)21-17-29(20-11-7-6-8-12-20)18-22(23(21)30)25(32)28(3)16-19-10-9-14-27(2)15-19/h17-20H,4-16H2,1-3H3,(H,26,31)/p+1/t19-/m0/s1