(8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) 3-piperidin-1-ium-1-ylpropanoate dichloride

Systemtic Name: (8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) 3-piperidin-1-ium-1-ylpropanoate dichloride Openeye Name: (8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) 3-piperidin-1-ium-1-ylpropanoate dichloride CAS Name: 3-(1-piperidin-1-iumyl)propanoic acid (8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) ester dichloride IUPAC Name: (8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) 3-piperidin-1-ium-1-ylpropanoate dichloride Traditional Name: 3-piperidin-1-ium-1-ylpropionic acid (8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) ester dichloride Formula: C16H30Cl2N2O2 MolecularWeight: 353.3276

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1C2CCC1CC(C2)OC(=O)CC[NH+]3CCCCC3.[Cl-].[Cl-]

Isomeric SMILES

C[NH+]1C2CCC1CC(C2)OC(=O)CC[NH+]3CCCCC3.[Cl-].[Cl-]

InChI

InChI=1S/C16H28N2O2.2ClH/c1-17-13-5-6-14(17)12-15(11-13)20-16(19)7-10-18-8-3-2-4-9-18;;/h13-15H,2-12H2,1H3;2*1H