4,4,5-trimethyl-2,3-dihydrothiochromene-8-carboxylic acid

Systemtic Name: 4,4,5-trimethyl-2,3-dihydrothiochromene-8-carboxylic acid Openeye Name: 4,4,5-trimethylthiochromane-8-carboxylic acid CAS Name: 4,4,5-trimethyl-2,3-dihydro-1-benzothiopyran-8-carboxylic acid IUPAC Name: 4,4,5-trimethyl-2,3-dihydrothiochromene-8-carboxylic acid Traditional Name: 4,4,5-trimethylthiochroman-8-carboxylic acid Formula: C13H16O2S MolecularWeight: 236.32994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C(=O)O)SCCC2(C)C

Isomeric SMILES

CC1=C2C(=C(C=C1)C(=O)O)SCCC2(C)C

InChI

InChI=1S/C13H16O2S/c1-8-4-5-9(12(14)15)11-10(8)13(2,3)6-7-16-11/h4-5H,6-7H2,1-3H3,(H,14,15)