3,3a,4,5-tetrahydro-2-benzothiophene-1-carboxylic acid

Systemtic Name: 3,3a,4,5-tetrahydro-2-benzothiophene-1-carboxylic acid Openeye Name: 3,3a,4,5-tetrahydro-2-benzothiophene-1-carboxylic acid CAS Name: 3,3a,4,5-tetrahydro-2-benzothiophene-1-carboxylic acid IUPAC Name: 3,3a,4,5-tetrahydro-2-benzothiophene-1-carboxylic acid Traditional Name: 3,3a,4,5-tetrahydroisobenzothiophene-1-carboxylic acid Formula: C9H10O2S MolecularWeight: 182.2395

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CSC(=C2C=C1)C(=O)O

Isomeric SMILES

C1CC2CSC(=C2C=C1)C(=O)O

InChI

InChI=1S/C9H10O2S/c10-9(11)8-7-4-2-1-3-6(7)5-12-8/h2,4,6H,1,3,5H2,(H,10,11)