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

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

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Descriptors Computed from Structure

Canonical SMILES:

CSN1CCCC(C12CCC(C2)CC3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

CSN1CCCC(C12CCC(C2)CC3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4

InChI

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