8-methyl-4-oxidanylidene-5-propan-2-yl-thiochromene-2-carboxylic acid

Systemtic Name: 8-methyl-4-oxidanylidene-5-propan-2-yl-thiochromene-2-carboxylic acid Openeye Name: 5-isopropyl-8-methyl-4-oxo-thiochromene-2-carboxylic acid CAS Name: 8-methyl-4-oxo-5-propan-2-yl-1-benzothiopyran-2-carboxylic acid IUPAC Name: 8-methyl-4-oxo-5-propan-2-ylthiochromene-2-carboxylic acid Traditional Name: 5-isopropyl-4-keto-8-methyl-thiochromene-2-carboxylic acid Formula: C14H14O3S MolecularWeight: 262.32416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C(C)C)C(=O)C=C(S2)C(=O)O

Isomeric SMILES

CC1=C2C(=C(C=C1)C(C)C)C(=O)C=C(S2)C(=O)O

InChI

InChI=1S/C14H14O3S/c1-7(2)9-5-4-8(3)13-12(9)10(15)6-11(18-13)14(16)17/h4-7H,1-3H3,(H,16,17)