dimethyl-[2-[3-(phenylmethyl)-3-aza-9-azoniabicyclo[3.3.1]nonan-9-yl]ethyl]azanium dichloride

Systemtic Name: dimethyl-[2-[3-(phenylmethyl)-3-aza-9-azoniabicyclo[3.3.1]nonan-9-yl]ethyl]azanium dichloride Openeye Name: 2-(3-benzyl-3-aza-9-azoniabicyclo[3.3.1]nonan-9-yl)ethyl-dimethyl-ammonium dichloride CAS Name: dimethyl-[2-[3-(phenylmethyl)-3-aza-9-azoniabicyclo[3.3.1]nonan-9-yl]ethyl]ammonium dichloride IUPAC Name: 2-(3-benzyl-3-aza-9-azoniabicyclo[3.3.1]nonan-9-yl)ethyl-dimethylazanium dichloride Traditional Name: 2-(3-benzyl-3-aza-9-azoniabicyclo[3.3.1]nonan-9-yl)ethyl-dimethyl-ammonium dichloride Formula: C18H31Cl2N3 MolecularWeight: 360.36484

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC[NH+]1C2CCCC1CN(C2)CC3=CC=CC=C3.[Cl-].[Cl-]

Isomeric SMILES

C[NH+](C)CC[NH+]1C2CCCC1CN(C2)CC3=CC=CC=C3.[Cl-].[Cl-]

InChI

InChI=1S/C18H29N3.2ClH/c1-19(2)11-12-21-17-9-6-10-18(21)15-20(14-17)13-16-7-4-3-5-8-16;;/h3-5,7-8,17-18H,6,9-15H2,1-2H3;2*1H