2-(2-methyl-1-oxidanylidene-3,4-dihydro-2H-thiochromen-4-yl)ethanoic acid

Systemtic Name: 2-(2-methyl-1-oxidanylidene-3,4-dihydro-2H-thiochromen-4-yl)ethanoic acid Openeye Name: 2-(2-methyl-1-oxo-3,4-dihydro-2H-thiochromen-4-yl)acetic acid CAS Name: 2-(2-methyl-1-oxo-3,4-dihydro-2H-1-benzothiopyran-4-yl)acetic acid IUPAC Name: 2-(2-methyl-1-oxo-3,4-dihydro-2H-thiochromen-4-yl)acetic acid Traditional Name: 2-(1-keto-2-methyl-3,4-dihydro-2H-thiochromen-4-yl)acetic acid Formula: C12H14O3S MolecularWeight: 238.30276

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C2=CC=CC=C2S1=O)CC(=O)O

Isomeric SMILES

CC1CC(C2=CC=CC=C2S1=O)CC(=O)O

InChI

InChI=1S/C12H14O3S/c1-8-6-9(7-12(13)14)10-4-2-3-5-11(10)16(8)15/h2-5,8-9H,6-7H2,1H3,(H,13,14)