phenyl 3-methylsulfanyl-6-(phenylmethyl)-10-azaspiro[4.5]decane-10-sulfonate

Systemtic Name: phenyl 3-methylsulfanyl-6-(phenylmethyl)-10-azaspiro[4.5]decane-10-sulfonate Openeye Name: phenyl 6-benzyl-3-methylsulfanyl-10-azaspiro[4.5]decane-10-sulfonate CAS Name: 3-(methylthio)-6-(phenylmethyl)-10-azaspiro[4.5]decane-10-sulfonic acid phenyl ester IUPAC Name: phenyl 6-benzyl-3-methylsulfanyl-10-azaspiro[4.5]decane-10-sulfonate Traditional Name: 6-benzyl-3-(methylthio)-10-azaspiro[4.5]decane-10-sulfonic acid phenyl ester Formula: C23H29NO3S2 MolecularWeight: 431.61126

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Descriptors Computed from Structure

Canonical SMILES:

CSC1CCC2(C1)C(CCCN2S(=O)(=O)OC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CSC1CCC2(C1)C(CCCN2S(=O)(=O)OC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H29NO3S2/c1-28-22-14-15-23(18-22)20(17-19-9-4-2-5-10-19)11-8-16-24(23)29(25,26)27-21-12-6-3-7-13-21/h2-7,9-10,12-13,20,22H,8,11,14-18H2,1H3