3-[2-(2-acetyloxyphenyl)carbonyloxyethyl-methyl-sulfonio]-7-chloranyl-4-oxidanylidene-chromen-2-olate

Systemtic Name: 3-[2-(2-acetyloxyphenyl)carbonyloxyethyl-methyl-sulfonio]-7-chloranyl-4-oxidanylidene-chromen-2-olate Openeye Name: 3-[2-(2-acetoxybenzoyl)oxyethyl-methyl-sulfonio]-7-chloro-4-oxo-chromen-2-olate CAS Name: 3-[2-[(2-acetyloxyphenyl)-oxomethoxy]ethyl-methylsulfonio]-7-chloro-4-oxo-1-benzopyran-2-olate IUPAC Name: 3-[2-(2-acetyloxybenzoyl)oxyethyl-methylsulfonio]-7-chloro-4-oxochromen-2-olate Traditional Name: 3-[2-(2-acetoxybenzoyl)oxyethyl-methyl-sulfonio]-7-chloro-4-keto-chromen-2-olate Formula: C21H17ClO7S MolecularWeight: 448.87348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)OCC[S+](C)C2=C(OC3=C(C2=O)C=CC(=C3)Cl)[O-]

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)OCC[S+](C)C2=C(OC3=C(C2=O)C=CC(=C3)Cl)[O-]

InChI

InChI=1S/C21H17ClO7S/c1-12(23)28-16-6-4-3-5-15(16)20(25)27-9-10-30(2)19-18(24)14-8-7-13(22)11-17(14)29-21(19)26/h3-8,11H,9-10H2,1-2H3