S-ethyl 2,2-dimethyl-3-oxidanyl-5-phenyl-pentanethioate

Systemtic Name: S-ethyl 2,2-dimethyl-3-oxidanyl-5-phenyl-pentanethioate Openeye Name: S-ethyl 3-hydroxy-2,2-dimethyl-5-phenyl-pentanethioate CAS Name: 3-hydroxy-2,2-dimethyl-5-phenylpentanethioic acid S-ethyl ester IUPAC Name: S-ethyl 3-hydroxy-2,2-dimethyl-5-phenylpentanethioate Traditional Name: 3-hydroxy-2,2-dimethyl-5-phenyl-pentanethioic acid S-ethyl ester Formula: C15H22O2S MolecularWeight: 266.39898

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)C(C)(C)C(CCC1=CC=CC=C1)O

Isomeric SMILES

CCSC(=O)C(C)(C)C(CCC1=CC=CC=C1)O

InChI

InChI=1S/C15H22O2S/c1-4-18-14(17)15(2,3)13(16)11-10-12-8-6-5-7-9-12/h5-9,13,16H,4,10-11H2,1-3H3