(8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) furan-2-carboxylate bromide

Systemtic Name: (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) furan-2-carboxylate bromide Openeye Name: (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) furan-2-carboxylate bromide CAS Name: 2-furancarboxylic acid (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) ester bromide IUPAC Name: (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) furan-2-carboxylate bromide Traditional Name: furan-2-carboxylic acid (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) ester bromide Formula: C14H20BrNO3 MolecularWeight: 330.2175

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C2CCC1CC(C2)OC(=O)C3=CC=CO3)C.[Br-]

Isomeric SMILES

C[N+]1(C2CCC1CC(C2)OC(=O)C3=CC=CO3)C.[Br-]

InChI

InChI=1S/C14H20NO3.BrH/c1-15(2)10-5-6-11(15)9-12(8-10)18-14(16)13-4-3-7-17-13;/h3-4,7,10-12H,5-6,8-9H2,1-2H3;1H/q+1;/p-1