1-(3-oxidanylcyclohexyl)-1-(phenylmethyl)pyridin-1-ium-2-one

Systemtic Name: 1-(3-oxidanylcyclohexyl)-1-(phenylmethyl)pyridin-1-ium-2-one Openeye Name: 1-benzyl-1-(3-hydroxycyclohexyl)pyridin-1-ium-2-one CAS Name: 1-(3-hydroxycyclohexyl)-1-(phenylmethyl)-2-pyridin-1-iumone IUPAC Name: 1-benzyl-1-(3-hydroxycyclohexyl)pyridin-1-ium-2-one Traditional Name: 1-benzyl-1-(3-hydroxycyclohexyl)pyridin-1-ium-2-one Formula: C18H22NO2+ MolecularWeight: 284.37278

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)O)[N+]2(C=CC=CC2=O)CC3=CC=CC=C3

Isomeric SMILES

C1CC(CC(C1)O)[N+]2(C=CC=CC2=O)CC3=CC=CC=C3

InChI

InChI=1S/C18H22NO2/c20-17-10-6-9-16(13-17)19(12-5-4-11-18(19)21)14-15-7-2-1-3-8-15/h1-5,7-8,11-12,16-17,20H,6,9-10,13-14H2/q+1