(9,9-dimethyl-9-azoniabicyclo[3.3.1]nonan-3-yl) furan-2-carboxylate chloride

Systemtic Name: (9,9-dimethyl-9-azoniabicyclo[3.3.1]nonan-3-yl) furan-2-carboxylate chloride Openeye Name: (9,9-dimethyl-9-azoniabicyclo[3.3.1]nonan-3-yl) furan-2-carboxylate chloride CAS Name: 2-furancarboxylic acid (9,9-dimethyl-9-azoniabicyclo[3.3.1]nonan-3-yl) ester chloride IUPAC Name: (9,9-dimethyl-9-azoniabicyclo[3.3.1]nonan-3-yl) furan-2-carboxylate chloride Traditional Name: furan-2-carboxylic acid (9,9-dimethyl-9-azoniabicyclo[3.3.1]nonan-3-yl) ester chloride Formula: C15H22ClNO3 MolecularWeight: 299.79308

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C2CCCC1CC(C2)OC(=O)C3=CC=CO3)C.[Cl-]

Isomeric SMILES

C[N+]1(C2CCCC1CC(C2)OC(=O)C3=CC=CO3)C.[Cl-]

InChI

InChI=1S/C15H22NO3.ClH/c1-16(2)11-5-3-6-12(16)10-13(9-11)19-15(17)14-7-4-8-18-14;/h4,7-8,11-13H,3,5-6,9-10H2,1-2H3;1H/q+1;/p-1