methyl (3R)-4-oxidanylidene-1H-isothiochromene-3-carboxylate

Systemtic Name: methyl (3R)-4-oxidanylidene-1H-isothiochromene-3-carboxylate Openeye Name: methyl (3R)-4-oxoisothiochromane-3-carboxylate CAS Name: (3R)-4-oxo-1H-2-benzothiopyran-3-carboxylic acid methyl ester IUPAC Name: methyl (3R)-4-oxo-1H-isothiochromene-3-carboxylate Traditional Name: (3R)-4-ketoisothiochroman-3-carboxylic acid methyl ester Formula: C11H10O3S MolecularWeight: 222.2603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(=O)C2=CC=CC=C2CS1

Isomeric SMILES

COC(=O)[C@H]1C(=O)C2=CC=CC=C2CS1

InChI

InChI=1S/C11H10O3S/c1-14-11(13)10-9(12)8-5-3-2-4-7(8)6-15-10/h2-5,10H,6H2,1H3/t10-/m1/s1