3-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid

Systemtic Name: 3-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid Openeye Name: 3-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid CAS Name: 3-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid Traditional Name: 3-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid Formula: C10H12O2S MolecularWeight: 196.26608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1CCCC2)C(=O)O

Isomeric SMILES

CC1=C(SC2=C1CCCC2)C(=O)O

InChI

InChI=1S/C10H12O2S/c1-6-7-4-2-3-5-8(7)13-9(6)10(11)12/h2-5H2,1H3,(H,11,12)