ethyl 3,3-dimethyl-5-phenylsulfanyl-pentanoate

Systemtic Name: ethyl 3,3-dimethyl-5-phenylsulfanyl-pentanoate Openeye Name: ethyl 3,3-dimethyl-5-phenylsulfanyl-pentanoate CAS Name: 3,3-dimethyl-5-(phenylthio)pentanoic acid ethyl ester IUPAC Name: ethyl 3,3-dimethyl-5-phenylsulfanylpentanoate Traditional Name: 3,3-dimethyl-5-(phenylthio)valeric acid ethyl ester Formula: C15H22O2S MolecularWeight: 266.39898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C)(C)CCSC1=CC=CC=C1

Isomeric SMILES

CCOC(=O)CC(C)(C)CCSC1=CC=CC=C1

InChI

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