3-methyl-2-(phenylsulfonyl)heptan-3-ol

Systemtic Name: 3-methyl-2-(phenylsulfonyl)heptan-3-ol Openeye Name: 2-(benzenesulfonyl)-3-methyl-heptan-3-ol CAS Name: 2-(benzenesulfonyl)-3-methyl-3-heptanol IUPAC Name: 2-(benzenesulfonyl)-3-methylheptan-3-ol Traditional Name: 2-besyl-3-methyl-heptan-3-ol Formula: C14H22O3S MolecularWeight: 270.38768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C(C)S(=O)(=O)C1=CC=CC=C1)O

Isomeric SMILES

CCCCC(C)(C(C)S(=O)(=O)C1=CC=CC=C1)O

InChI

InChI=1S/C14H22O3S/c1-4-5-11-14(3,15)12(2)18(16,17)13-9-7-6-8-10-13/h6-10,12,15H,4-5,11H2,1-3H3