2-(1-hydroxyethyl)-3-phenylsulfanyl-cyclohexan-1-one

Systemtic Name: 2-(1-hydroxyethyl)-3-phenylsulfanyl-cyclohexan-1-one Openeye Name: 2-(1-hydroxyethyl)-3-phenylsulfanyl-cyclohexanone CAS Name: 2-(1-hydroxyethyl)-3-(phenylthio)-1-cyclohexanone IUPAC Name: 2-(1-hydroxyethyl)-3-phenylsulfanylcyclohexan-1-one Traditional Name: 2-(1-hydroxyethyl)-3-(phenylthio)cyclohexanone Formula: C14H18O2S MolecularWeight: 250.35652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C(CCCC1=O)SC2=CC=CC=C2)O

Isomeric SMILES

CC(C1C(CCCC1=O)SC2=CC=CC=C2)O

InChI

InChI=1S/C14H18O2S/c1-10(15)14-12(16)8-5-9-13(14)17-11-6-3-2-4-7-11/h2-4,6-7,10,13-15H,5,8-9H2,1H3