phenyl 7-methoxy-9-methylsulfanyl-9-azaspiro[4.4]nonane-3-sulfonate

Systemtic Name: phenyl 7-methoxy-9-methylsulfanyl-9-azaspiro[4.4]nonane-3-sulfonate Openeye Name: phenyl 7-methoxy-9-methylsulfanyl-9-azaspiro[4.4]nonane-3-sulfonate CAS Name: 7-methoxy-9-(methylthio)-9-azaspiro[4.4]nonane-3-sulfonic acid phenyl ester IUPAC Name: phenyl 7-methoxy-9-methylsulfanyl-9-azaspiro[4.4]nonane-3-sulfonate Traditional Name: 7-methoxy-9-(methylthio)-9-azaspiro[4.4]nonane-3-sulfonic acid phenyl ester Formula: C16H23NO4S2 MolecularWeight: 357.48812

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC2(CCC(C2)S(=O)(=O)OC3=CC=CC=C3)N(C1)SC

Isomeric SMILES

COC1CC2(CCC(C2)S(=O)(=O)OC3=CC=CC=C3)N(C1)SC

InChI

InChI=1S/C16H23NO4S2/c1-20-14-10-16(17(12-14)22-2)9-8-15(11-16)23(18,19)21-13-6-4-3-5-7-13/h3-7,14-15H,8-12H2,1-2H3