2-sulfanylidene-3-(3,4,5-trimethoxyphenyl)propanoic acid

Systemtic Name: 2-sulfanylidene-3-(3,4,5-trimethoxyphenyl)propanoic acid Openeye Name: 2-thioxo-3-(3,4,5-trimethoxyphenyl)propanoic acid CAS Name: 2-sulfanylidene-3-(3,4,5-trimethoxyphenyl)propanoic acid IUPAC Name: 2-sulfanylidene-3-(3,4,5-trimethoxyphenyl)propanoic acid Traditional Name: 2-thioxo-3-(3,4,5-trimethoxyphenyl)propionic acid Formula: C12H14O5S MolecularWeight: 270.30156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC(=S)C(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC(=S)C(=O)O

InChI

InChI=1S/C12H14O5S/c1-15-8-4-7(6-10(18)12(13)14)5-9(16-2)11(8)17-3/h4-5H,6H2,1-3H3,(H,13,14)