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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)O

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)O

InChI

InChI=1S/C10H12O2S/c1-6-2-3-8-7(4-6)5-9(13-8)10(11)12/h5-6H,2-4H2,1H3,(H,11,12)