(5S,7R)-3-(4-methylsulfonylphenyl)adamantan-1-ol

Systemtic Name: (5S,7R)-3-(4-methylsulfonylphenyl)adamantan-1-ol Openeye Name: (5S,7R)-3-(4-methylsulfonylphenyl)adamantan-1-ol CAS Name: (5S,7R)-3-(4-methylsulfonylphenyl)-1-adamantanol IUPAC Name: (5S,7R)-3-(4-methylsulfonylphenyl)adamantan-1-ol Traditional Name: (5S,7R)-3-(4-mesylphenyl)adamantan-1-ol Formula: C17H22O3S MolecularWeight: 306.41978

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)O

InChI

InChI=1S/C17H22O3S/c1-21(19,20)15-4-2-14(3-5-15)16-7-12-6-13(8-16)10-17(18,9-12)11-16/h2-5,12-13,18H,6-11H2,1H3/t12-,13+,16?,17?