ethyl 2-cyclohexylsulfanyl-4-oxidanylidene-4-phenyl-butanoate

Systemtic Name: ethyl 2-cyclohexylsulfanyl-4-oxidanylidene-4-phenyl-butanoate Openeye Name: ethyl 2-cyclohexylsulfanyl-4-oxo-4-phenyl-butanoate CAS Name: 2-(cyclohexylthio)-4-oxo-4-phenylbutanoic acid ethyl ester IUPAC Name: ethyl 2-cyclohexylsulfanyl-4-oxo-4-phenylbutanoate Traditional Name: 2-(cyclohexylthio)-4-keto-4-phenyl-butyric acid ethyl ester Formula: C18H24O3S MolecularWeight: 320.44636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(=O)C1=CC=CC=C1)SC2CCCCC2

Isomeric SMILES

CCOC(=O)C(CC(=O)C1=CC=CC=C1)SC2CCCCC2

InChI

InChI=1S/C18H24O3S/c1-2-21-18(20)17(22-15-11-7-4-8-12-15)13-16(19)14-9-5-3-6-10-14/h3,5-6,9-10,15,17H,2,4,7-8,11-13H2,1H3