2-[3-methylsulfanyl-9-(phenylsulfonyl)-9-azaspiro[4.4]nonan-7-yl]phenol

Systemtic Name: 2-[3-methylsulfanyl-9-(phenylsulfonyl)-9-azaspiro[4.4]nonan-7-yl]phenol Openeye Name: 2-[9-(benzenesulfonyl)-3-methylsulfanyl-9-azaspiro[4.4]nonan-7-yl]phenol CAS Name: 2-[9-(benzenesulfonyl)-3-(methylthio)-9-azaspiro[4.4]nonan-7-yl]phenol IUPAC Name: 2-[9-(benzenesulfonyl)-3-methylsulfanyl-9-azaspiro[4.4]nonan-7-yl]phenol Traditional Name: 2-[9-besyl-3-(methylthio)-9-azaspiro[4.4]nonan-7-yl]phenol Formula: C21H25NO3S2 MolecularWeight: 403.5581

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Descriptors Computed from Structure

Canonical SMILES:

CSC1CCC2(C1)CC(CN2S(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4O

Isomeric SMILES

CSC1CCC2(C1)CC(CN2S(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4O

InChI

InChI=1S/C21H25NO3S2/c1-26-17-11-12-21(14-17)13-16(19-9-5-6-10-20(19)23)15-22(21)27(24,25)18-7-3-2-4-8-18/h2-10,16-17,23H,11-15H2,1H3