methyl 2,2-dimethyl-4-oxidanylidene-3H-chromene-7-sulfonate

Systemtic Name: methyl 2,2-dimethyl-4-oxidanylidene-3H-chromene-7-sulfonate Openeye Name: methyl 2,2-dimethyl-4-oxo-chromane-7-sulfonate CAS Name: 2,2-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-7-sulfonic acid methyl ester IUPAC Name: methyl 2,2-dimethyl-4-oxo-3H-chromene-7-sulfonate Traditional Name: 4-keto-2,2-dimethyl-chroman-7-sulfonic acid methyl ester Formula: C12H14O5S MolecularWeight: 270.30156

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2=C(O1)C=C(C=C2)S(=O)(=O)OC)C

Isomeric SMILES

CC1(CC(=O)C2=C(O1)C=C(C=C2)S(=O)(=O)OC)C

InChI

InChI=1S/C12H14O5S/c1-12(2)7-10(13)9-5-4-8(6-11(9)17-12)18(14,15)16-3/h4-6H,7H2,1-3H3