8-chloranyl-5-methyl-4-oxidanylidene-2,3-dihydrothiochromene-6-carboxylic acid

Systemtic Name: 8-chloranyl-5-methyl-4-oxidanylidene-2,3-dihydrothiochromene-6-carboxylic acid Openeye Name: 8-chloro-5-methyl-4-oxo-thiochromane-6-carboxylic acid CAS Name: 8-chloro-5-methyl-4-oxo-2,3-dihydro-1-benzothiopyran-6-carboxylic acid IUPAC Name: 8-chloro-5-methyl-4-oxo-2,3-dihydrothiochromene-6-carboxylic acid Traditional Name: 8-chloro-4-keto-5-methyl-thiochroman-6-carboxylic acid Formula: C11H9ClO3S MolecularWeight: 256.70536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=O)CCSC2=C(C=C1C(=O)O)Cl

Isomeric SMILES

CC1=C2C(=O)CCSC2=C(C=C1C(=O)O)Cl

InChI

InChI=1S/C11H9ClO3S/c1-5-6(11(14)15)4-7(12)10-9(5)8(13)2-3-16-10/h4H,2-3H2,1H3,(H,14,15)