(4-methanoyl-2-methoxy-phenyl) 7,8-dimethoxy-1-oxidanylidene-isothiochromene-3-carboxylate

Systemtic Name: (4-methanoyl-2-methoxy-phenyl) 7,8-dimethoxy-1-oxidanylidene-isothiochromene-3-carboxylate Openeye Name: (4-formyl-2-methoxy-phenyl) 7,8-dimethoxy-1-oxo-isothiochromene-3-carboxylate CAS Name: 7,8-dimethoxy-1-oxo-2-benzothiopyran-3-carboxylic acid (4-formyl-2-methoxyphenyl) ester IUPAC Name: (4-formyl-2-methoxyphenyl) 7,8-dimethoxy-1-oxoisothiochromene-3-carboxylate Traditional Name: 1-keto-7,8-dimethoxy-isothiochromene-3-carboxylic acid (4-formyl-2-methoxy-phenyl) ester Formula: C20H16O7S MolecularWeight: 400.40184

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C=C(SC2=O)C(=O)OC3=C(C=C(C=C3)C=O)OC)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C=C(SC2=O)C(=O)OC3=C(C=C(C=C3)C=O)OC)OC

InChI

InChI=1S/C20H16O7S/c1-24-14-7-5-12-9-16(28-20(23)17(12)18(14)26-3)19(22)27-13-6-4-11(10-21)8-15(13)25-2/h4-10H,1-3H3