S-[3-(3,4-dimethoxyphenyl)-3-oxidanylidene-propyl] ethanethioate

Systemtic Name: S-[3-(3,4-dimethoxyphenyl)-3-oxidanylidene-propyl] ethanethioate Openeye Name: S-[3-(3,4-dimethoxyphenyl)-3-oxo-propyl] ethanethioate CAS Name: ethanethioic acid S-[3-(3,4-dimethoxyphenyl)-3-oxopropyl] ester IUPAC Name: S-[3-(3,4-dimethoxyphenyl)-3-oxopropyl] ethanethioate Traditional Name: ethanethioic acid S-[3-(3,4-dimethoxyphenyl)-3-keto-propyl] ester Formula: C13H16O4S MolecularWeight: 268.32874

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCC(=O)C1=CC(=C(C=C1)OC)OC

Isomeric SMILES

CC(=O)SCCC(=O)C1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C13H16O4S/c1-9(14)18-7-6-11(15)10-4-5-12(16-2)13(8-10)17-3/h4-5,8H,6-7H2,1-3H3