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3,3-dimethyl-2,4-dihydrothiochromene-6-carboxylic acid

3,3-dimethyl-2,4-dihydrothiochromene-6-carboxylic acid

Systemtic Name:3,3-dimethyl-2,4-dihydrothiochromene-6-carboxylic acid
Openeye Name:3,3-dimethylthiochromane-6-carboxylic acid
CAS Name:3,3-dimethyl-2,4-dihydro-1-benzothiopyran-6-carboxylic acid
IUPAC Name:3,3-dimethyl-2,4-dihydrothiochromene-6-carboxylic acid
Traditional Name:3,3-dimethylthiochroman-6-carboxylic acid
Formula: C12H14O2S
MolecularWeight: 222.30336
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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=CC(=C2)C(=O)O)SC1)C


Isomeric SMILES

CC1(CC2=C(C=CC(=C2)C(=O)O)SC1)C


InChI

InChI=1S/C12H14O2S/c1-12(2)6-9-5-8(11(13)14)3-4-10(9)15-7-12/h3-5H,6-7H2,1-2H3,(H,13,14)


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