methyl 3-[(1R)-1-ethyl-2-oxidanylidene-4-phenylsulfanyl-cyclohexyl]propanoate

Systemtic Name: methyl 3-[(1R)-1-ethyl-2-oxidanylidene-4-phenylsulfanyl-cyclohexyl]propanoate Openeye Name: methyl 3-[(1R)-1-ethyl-2-oxo-4-phenylsulfanyl-cyclohexyl]propanoate CAS Name: 3-[(1R)-1-ethyl-2-oxo-4-(phenylthio)cyclohexyl]propanoic acid methyl ester IUPAC Name: methyl 3-[(1R)-1-ethyl-2-oxo-4-phenylsulfanylcyclohexyl]propanoate Traditional Name: 3-[(1R)-1-ethyl-2-keto-4-(phenylthio)cyclohexyl]propionic acid methyl ester Formula: C18H24O3S MolecularWeight: 320.44636

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCC(CC1=O)SC2=CC=CC=C2)CCC(=O)OC

Isomeric SMILES

CC[C@]1(CCC(CC1=O)SC2=CC=CC=C2)CCC(=O)OC

InChI

InChI=1S/C18H24O3S/c1-3-18(12-10-17(20)21-2)11-9-15(13-16(18)19)22-14-7-5-4-6-8-14/h4-8,15H,3,9-13H2,1-2H3/t15?,18-/m0/s1