5-azoniaspiro[4.4]nonan-8-yl 2-oxidanyl-2,2-diphenyl-ethanoate bromide

Systemtic Name: 5-azoniaspiro[4.4]nonan-8-yl 2-oxidanyl-2,2-diphenyl-ethanoate bromide Openeye Name: 5-azoniaspiro[4.4]nonan-8-yl 2-hydroxy-2,2-diphenyl-acetate bromide CAS Name: 2-hydroxy-2,2-diphenylacetic acid 5-azoniaspiro[4.4]nonan-8-yl ester bromide IUPAC Name: 5-azoniaspiro[4.4]nonan-8-yl 2-hydroxy-2,2-diphenylacetate bromide Traditional Name: 2-hydroxy-2,2-diphenyl-acetic acid 5-azoniaspiro[4.4]nonan-8-yl ester bromide Formula: C22H26BrNO3 MolecularWeight: 432.35074

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+]2(C1)CCC(C2)OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O.[Br-]

Isomeric SMILES

C1CC[N+]2(C1)CCC(C2)OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O.[Br-]

InChI

InChI=1S/C22H26NO3.BrH/c24-21(26-20-13-16-23(17-20)14-7-8-15-23)22(25,18-9-3-1-4-10-18)19-11-5-2-6-12-19;/h1-6,9-12,20,25H,7-8,13-17H2;1H/q+1;/p-1