4-[(5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-oxidanyl-methyl]quinolin-6-ol chloride

Systemtic Name: 4-[(5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-oxidanyl-methyl]quinolin-6-ol chloride Openeye Name: 4-[hydroxy-(5-vinylquinuclidin-1-ium-2-yl)methyl]quinolin-6-ol chloride CAS Name: 4-[(5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-hydroxymethyl]-6-quinolinol chloride IUPAC Name: 4-[(5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl)-hydroxymethyl]quinolin-6-ol chloride Traditional Name: 4-[hydroxy-(5-vinylquinuclidin-1-ium-2-yl)methyl]quinolin-6-ol chloride Formula: C19H23ClN2O2 MolecularWeight: 346.85112

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1C[NH+]2CCC1CC2C(C3=C4C=C(C=CC4=NC=C3)O)O.[Cl-]

Isomeric SMILES

C=CC1C[NH+]2CCC1CC2C(C3=C4C=C(C=CC4=NC=C3)O)O.[Cl-]

InChI

InChI=1S/C19H22N2O2.ClH/c1-2-12-11-21-8-6-13(12)9-18(21)19(23)15-5-7-20-17-4-3-14(22)10-16(15)17;/h2-5,7,10,12-13,18-19,22-23H,1,6,8-9,11H2;1H