2-(2,2-dimethyl-4-oxidanylidene-3H-thiochromen-3-yl)-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-(2,2-dimethyl-4-oxidanylidene-3H-thiochromen-3-yl)-2-oxidanylidene-ethanoic acid Openeye Name: 2-(2,2-dimethyl-4-oxo-thiochroman-3-yl)-2-oxo-acetic acid CAS Name: 2-(2,2-dimethyl-4-oxo-3H-1-benzothiopyran-3-yl)-2-oxoacetic acid IUPAC Name: 2-(2,2-dimethyl-4-oxo-3H-thiochromen-3-yl)-2-oxoacetic acid Traditional Name: 2-keto-2-(4-keto-2,2-dimethyl-thiochroman-3-yl)acetic acid Formula: C13H12O4S MolecularWeight: 264.29698

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(=O)C2=CC=CC=C2S1)C(=O)C(=O)O)C

Isomeric SMILES

CC1(C(C(=O)C2=CC=CC=C2S1)C(=O)C(=O)O)C

InChI

InChI=1S/C13H12O4S/c1-13(2)9(11(15)12(16)17)10(14)7-5-3-4-6-8(7)18-13/h3-6,9H,1-2H3,(H,16,17)