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

Systemtic Name: 5-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid Openeye Name: 5-ethyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid CAS Name: 5-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid IUPAC Name: 5-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid Traditional Name: 5-ethyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid Formula: C11H14O2S MolecularWeight: 210.29266

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)C=C(S2)C(=O)O

Isomeric SMILES

CCC1CCC2=C(C1)C=C(S2)C(=O)O

InChI

InChI=1S/C11H14O2S/c1-2-7-3-4-9-8(5-7)6-10(14-9)11(12)13/h6-7H,2-5H2,1H3,(H,12,13)