2-[4-(2-methyloctan-2-yl)-2-oxidanyl-phenyl]-1-methylsulfonyl-piperidin-4-ol

Systemtic Name: 2-[4-(2-methyloctan-2-yl)-2-oxidanyl-phenyl]-1-methylsulfonyl-piperidin-4-ol Openeye Name: 2-[4-(1,1-dimethylheptyl)-2-hydroxy-phenyl]-1-methylsulfonyl-piperidin-4-ol CAS Name: 2-[2-hydroxy-4-(2-methyloctan-2-yl)phenyl]-1-methylsulfonyl-4-piperidinol IUPAC Name: 2-[2-hydroxy-4-(2-methyloctan-2-yl)phenyl]-1-methylsulfonylpiperidin-4-ol Traditional Name: 2-[4-(1,1-dimethylheptyl)-2-hydroxy-phenyl]-1-mesyl-piperidin-4-ol Formula: C21H35NO4S MolecularWeight: 397.5719

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CC(CCN2S(=O)(=O)C)O)O

Isomeric SMILES

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CC(CCN2S(=O)(=O)C)O)O

InChI

InChI=1S/C21H35NO4S/c1-5-6-7-8-12-21(2,3)16-9-10-18(20(24)14-16)19-15-17(23)11-13-22(19)27(4,25)26/h9-10,14,17,19,23-24H,5-8,11-13,15H2,1-4H3