5-chloranyl-4,4,8-trimethyl-1,1-bis(oxidanylidene)-2,3-dihydrothiochromene-6-carboxylic acid

Systemtic Name: 5-chloranyl-4,4,8-trimethyl-1,1-bis(oxidanylidene)-2,3-dihydrothiochromene-6-carboxylic acid Openeye Name: 5-chloro-4,4,8-trimethyl-1,1-dioxo-2,3-dihydrothiochromene-6-carboxylic acid CAS Name: 5-chloro-4,4,8-trimethyl-1,1-dioxo-2,3-dihydro-1-benzothiopyran-6-carboxylic acid IUPAC Name: 5-chloro-4,4,8-trimethyl-1,1-dioxo-2,3-dihydrothiochromene-6-carboxylic acid Traditional Name: 5-chloro-1,1-diketo-4,4,8-trimethyl-2,3-dihydrothiochromene-6-carboxylic acid Formula: C13H15ClO4S MolecularWeight: 302.7738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1)C(=O)O)Cl)C(CCS2(=O)=O)(C)C

Isomeric SMILES

CC1=C2C(=C(C(=C1)C(=O)O)Cl)C(CCS2(=O)=O)(C)C

InChI

InChI=1S/C13H15ClO4S/c1-7-6-8(12(15)16)10(14)9-11(7)19(17,18)5-4-13(9,2)3/h6H,4-5H2,1-3H3,(H,15,16)