(2-oxidanylidene-2-thiophen-2-yl-ethyl) 3,5-dimethoxy-4-oxidanyl-benzoate

Systemtic Name: (2-oxidanylidene-2-thiophen-2-yl-ethyl) 3,5-dimethoxy-4-oxidanyl-benzoate Openeye Name: [2-oxo-2-(2-thienyl)ethyl] 4-hydroxy-3,5-dimethoxy-benzoate CAS Name: 4-hydroxy-3,5-dimethoxybenzoic acid (2-oxo-2-thiophen-2-ylethyl) ester IUPAC Name: (2-oxo-2-thiophen-2-ylethyl) 4-hydroxy-3,5-dimethoxybenzoate Traditional Name: 4-hydroxy-3,5-dimethoxy-benzoic acid [2-keto-2-(2-thienyl)ethyl] ester Formula: C15H14O6S MolecularWeight: 322.33306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)C(=O)OCC(=O)C2=CC=CS2

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)C(=O)OCC(=O)C2=CC=CS2

InChI

InChI=1S/C15H14O6S/c1-19-11-6-9(7-12(20-2)14(11)17)15(18)21-8-10(16)13-4-3-5-22-13/h3-7,17H,8H2,1-2H3