methanesulfonate; 4-phenylspiro[7-azoniabicyclo[2.2.1]heptane-7,1'-azinan-1-ium]

Systemtic Name: methanesulfonate; 4-phenylspiro[7-azoniabicyclo[2.2.1]heptane-7,1'-azinan-1-ium] Openeye Name: methanesulfonate; 4-phenylspiro[7-azoniabicyclo[2.2.1]heptane-7,1'-azinan-1-ium] CAS Name: methanesulfonate; 4-phenylspiro[7-azoniabicyclo[2.2.1]heptane-7,1'-azinan-1-ium] IUPAC Name: methanesulfonate; 4-phenylspiro[7-azoniabicyclo[2.2.1]heptane-7,1'-azinan-1-ium] Traditional Name: 4-phenylspiro[7-azoniabicyclo[2.2.1]heptane-7,1'-azinan-1-ium] mesylate Formula: C18H27NO3S MolecularWeight: 337.47688

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)[O-].C1CC[N+]2(CC1)C3CCC2(CC3)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)[O-].C1CC[N+]2(CC1)C3CCC2(CC3)C4=CC=CC=C4

InChI

InChI=1S/C17H24N.CH4O3S/c1-3-7-15(8-4-1)17-11-9-16(10-12-17)18(17)13-5-2-6-14-18;1-5(2,3)4/h1,3-4,7-8,16H,2,5-6,9-14H2;1H3,(H,2,3,4)/q+1;/p-1