methyl 3-(3-oxidanylidenecyclopentyl)-3-phenylsulfanyl-propanoate

Systemtic Name: methyl 3-(3-oxidanylidenecyclopentyl)-3-phenylsulfanyl-propanoate Openeye Name: methyl 3-(3-oxocyclopentyl)-3-phenylsulfanyl-propanoate CAS Name: 3-(3-oxocyclopentyl)-3-(phenylthio)propanoic acid methyl ester IUPAC Name: methyl 3-(3-oxocyclopentyl)-3-phenylsulfanylpropanoate Traditional Name: 3-(3-ketocyclopentyl)-3-(phenylthio)propionic acid methyl ester Formula: C15H18O3S MolecularWeight: 278.36662

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1CCC(=O)C1)SC2=CC=CC=C2

Isomeric SMILES

COC(=O)CC(C1CCC(=O)C1)SC2=CC=CC=C2

InChI

InChI=1S/C15H18O3S/c1-18-15(17)10-14(11-7-8-12(16)9-11)19-13-5-3-2-4-6-13/h2-6,11,14H,7-10H2,1H3