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5-(hydroxymethyl)-2-methyl-4-[[(1-piperidin-1-ium-1-ylcyclohexyl)methylamino]methylidene]pyridin-3-one

5-(hydroxymethyl)-2-methyl-4-[[(1-piperidin-1-ium-1-ylcyclohexyl)methylamino]methylidene]pyridin-3-one

Systemtic Name:5-(hydroxymethyl)-2-methyl-4-[[(1-piperidin-1-ium-1-ylcyclohexyl)methylamino]methylidene]pyridin-3-one
Openeye Name:5-(hydroxymethyl)-2-methyl-4-[[(1-piperidin-1-ium-1-ylcyclohexyl)methylamino]methylene]pyridin-3-one
CAS Name:5-(hydroxymethyl)-2-methyl-4-[[[1-(1-piperidin-1-iumyl)cyclohexyl]methylamino]methylidene]-3-pyridinone
IUPAC Name:5-(hydroxymethyl)-2-methyl-4-[[(1-piperidin-1-ium-1-ylcyclohexyl)methylamino]methylidene]pyridin-3-one
Traditional Name:2-methyl-5-methylol-4-[[(1-piperidin-1-ium-1-ylcyclohexyl)methylamino]methylene]pyridin-3-one
Formula: C20H32N3O2+
MolecularWeight: 346.48698
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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=CNCC2(CCCCC2)[NH+]3CCCCC3)C1=O)CO


Isomeric SMILES

CC1=NC=C(C(=CNCC2(CCCCC2)[NH+]3CCCCC3)C1=O)CO


InChI

InChI=1S/C20H31N3O2/c1-16-19(25)18(17(14-24)12-22-16)13-21-15-20(8-4-2-5-9-20)23-10-6-3-7-11-23/h12-13,21,24H,2-11,14-15H2,1H3/p+1


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