3-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]thian-4-one

Systemtic Name: 3-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]thian-4-one Openeye Name: 3-[2-(4-methoxyphenyl)-2-oxo-ethyl]tetrahydrothiopyran-4-one CAS Name: 3-[2-(4-methoxyphenyl)-2-oxoethyl]-4-thianone IUPAC Name: 3-[2-(4-methoxyphenyl)-2-oxoethyl]thian-4-one Traditional Name: 3-[2-keto-2-(4-methoxyphenyl)ethyl]tetrahydrothiopyran-4-one Formula: C14H16O3S MolecularWeight: 264.34004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CC2CSCCC2=O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CC2CSCCC2=O

InChI

InChI=1S/C14H16O3S/c1-17-12-4-2-10(3-5-12)14(16)8-11-9-18-7-6-13(11)15/h2-5,11H,6-9H2,1H3