6-(2-methylbutan-2-yl)-1-benzothiophene-3-carboxylate

Systemtic Name: 6-(2-methylbutan-2-yl)-1-benzothiophene-3-carboxylate Openeye Name: 6-(1,1-dimethylpropyl)benzothiophene-3-carboxylate CAS Name: 6-(2-methylbutan-2-yl)-1-benzothiophene-3-carboxylate IUPAC Name: 6-(2-methylbutan-2-yl)-1-benzothiophene-3-carboxylate Traditional Name: 6-tert-amylbenzothiophene-3-carboxylate Formula: C14H15O2S- MolecularWeight: 247.3327

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC2=C(C=C1)C(=CS2)C(=O)[O-]

Isomeric SMILES

CCC(C)(C)C1=CC2=C(C=C1)C(=CS2)C(=O)[O-]

InChI

InChI=1S/C14H16O2S/c1-4-14(2,3)9-5-6-10-11(13(15)16)8-17-12(10)7-9/h5-8H,4H2,1-3H3,(H,15,16)/p-1