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

Systemtic Name: 3-[2-acetyloxyethyl(methyl)sulfonio]-7-chloranyl-4-oxidanylidene-chromen-2-olate Openeye Name: 3-[2-acetoxyethyl(methyl)sulfonio]-7-chloro-4-oxo-chromen-2-olate CAS Name: 3-[2-acetyloxyethyl(methyl)sulfonio]-7-chloro-4-oxo-1-benzopyran-2-olate IUPAC Name: 3-[2-acetyloxyethyl(methyl)sulfonio]-7-chloro-4-oxochromen-2-olate Traditional Name: 3-[2-acetoxyethyl(methyl)sulfonio]-7-chloro-4-keto-chromen-2-olate Formula: C14H13ClO5S MolecularWeight: 328.76802

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC[S+](C)C1=C(OC2=C(C1=O)C=CC(=C2)Cl)[O-]

Isomeric SMILES

CC(=O)OCC[S+](C)C1=C(OC2=C(C1=O)C=CC(=C2)Cl)[O-]

InChI

InChI=1S/C14H13ClO5S/c1-8(16)19-5-6-21(2)13-12(17)10-4-3-9(15)7-11(10)20-14(13)18/h3-4,7H,5-6H2,1-2H3