1-azoniabicyclo[2.2.2]octan-3-yl-[(3-methoxyphenyl)methyl]azanium dichloride

Systemtic Name: 1-azoniabicyclo[2.2.2]octan-3-yl-[(3-methoxyphenyl)methyl]azanium dichloride Openeye Name: (3-methoxyphenyl)methyl-quinuclidin-1-ium-3-yl-ammonium dichloride CAS Name: 1-azoniabicyclo[2.2.2]octan-3-yl-[(3-methoxyphenyl)methyl]ammonium dichloride IUPAC Name: 1-azoniabicyclo[2.2.2]octan-3-yl-[(3-methoxyphenyl)methyl]azanium dichloride Traditional Name: m-anisyl(quinuclidin-1-ium-3-yl)ammonium dichloride Formula: C15H24Cl2N2O MolecularWeight: 319.26986

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C[NH2+]C2C[NH+]3CCC2CC3.[Cl-].[Cl-]

Isomeric SMILES

COC1=CC=CC(=C1)C[NH2+]C2C[NH+]3CCC2CC3.[Cl-].[Cl-]

InChI

InChI=1S/C15H22N2O.2ClH/c1-18-14-4-2-3-12(9-14)10-16-15-11-17-7-5-13(15)6-8-17;;/h2-4,9,13,15-16H,5-8,10-11H2,1H3;2*1H