3,3-dimethyl-7-phenyl-1-sulfanyl-heptan-2-ol

Systemtic Name: 3,3-dimethyl-7-phenyl-1-sulfanyl-heptan-2-ol Openeye Name: 3,3-dimethyl-7-phenyl-1-sulfanyl-heptan-2-ol CAS Name: 1-mercapto-3,3-dimethyl-7-phenyl-2-heptanol IUPAC Name: 3,3-dimethyl-7-phenyl-1-sulfanylheptan-2-ol Traditional Name: 1-mercapto-3,3-dimethyl-7-phenyl-heptan-2-ol Formula: C15H24OS MolecularWeight: 252.41546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCC1=CC=CC=C1)C(CS)O

Isomeric SMILES

CC(C)(CCCCC1=CC=CC=C1)C(CS)O

InChI

InChI=1S/C15H24OS/c1-15(2,14(16)12-17)11-7-6-10-13-8-4-3-5-9-13/h3-5,8-9,14,16-17H,6-7,10-12H2,1-2H3