methyl 2-[4-(3-oxidanylidenecyclohexyl)sulfanylphenyl]ethanoate

Systemtic Name: methyl 2-[4-(3-oxidanylidenecyclohexyl)sulfanylphenyl]ethanoate Openeye Name: methyl 2-[4-(3-oxocyclohexyl)sulfanylphenyl]acetate CAS Name: 2-[4-[(3-oxocyclohexyl)thio]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(3-oxocyclohexyl)sulfanylphenyl]acetate Traditional Name: 2-[4-[(3-ketocyclohexyl)thio]phenyl]acetic acid methyl ester Formula: C15H18O3S MolecularWeight: 278.36662

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC=C(C=C1)SC2CCCC(=O)C2

Isomeric SMILES

COC(=O)CC1=CC=C(C=C1)SC2CCCC(=O)C2

InChI

InChI=1S/C15H18O3S/c1-18-15(17)9-11-5-7-13(8-6-11)19-14-4-2-3-12(16)10-14/h5-8,14H,2-4,9-10H2,1H3