7-chloranyl-3,3,4-trimethyl-2H-1-benzothiophene-5-carboxylic acid

Systemtic Name: 7-chloranyl-3,3,4-trimethyl-2H-1-benzothiophene-5-carboxylic acid Openeye Name: 7-chloro-3,3,4-trimethyl-2H-benzothiophene-5-carboxylic acid CAS Name: 7-chloro-3,3,4-trimethyl-2H-1-benzothiophene-5-carboxylic acid IUPAC Name: 7-chloro-3,3,4-trimethyl-2H-1-benzothiophene-5-carboxylic acid Traditional Name: 7-chloro-3,3,4-trimethyl-2H-benzothiophene-5-carboxylic acid Formula: C12H13ClO2S MolecularWeight: 256.74842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1C(=O)O)Cl)SCC2(C)C

Isomeric SMILES

CC1=C2C(=C(C=C1C(=O)O)Cl)SCC2(C)C

InChI

InChI=1S/C12H13ClO2S/c1-6-7(11(14)15)4-8(13)10-9(6)12(2,3)5-16-10/h4H,5H2,1-3H3,(H,14,15)