ethyl 3-oxidanyl-3-(1-phenylsulfanylcyclohexyl)propanoate

Systemtic Name: ethyl 3-oxidanyl-3-(1-phenylsulfanylcyclohexyl)propanoate Openeye Name: ethyl 3-hydroxy-3-(1-phenylsulfanylcyclohexyl)propanoate CAS Name: 3-hydroxy-3-[1-(phenylthio)cyclohexyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-hydroxy-3-(1-phenylsulfanylcyclohexyl)propanoate Traditional Name: 3-hydroxy-3-[1-(phenylthio)cyclohexyl]propionic acid ethyl ester Formula: C17H24O3S MolecularWeight: 308.43566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1(CCCCC1)SC2=CC=CC=C2)O

Isomeric SMILES

CCOC(=O)CC(C1(CCCCC1)SC2=CC=CC=C2)O

InChI

InChI=1S/C17H24O3S/c1-2-20-16(19)13-15(18)17(11-7-4-8-12-17)21-14-9-5-3-6-10-14/h3,5-6,9-10,15,18H,2,4,7-8,11-13H2,1H3