(5S)-5-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

Systemtic Name: (5S)-5-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Openeye Name: (5S)-5-(1,1-dimethylpropyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxylate CAS Name: (5S)-5-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate IUPAC Name: (5S)-5-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Traditional Name: (5S)-5-tert-amyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxylate Formula: C14H19O2S- MolecularWeight: 251.36446

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)[O-]

Isomeric SMILES

CCC(C)(C)[C@H]1CCC2=C(C1)C=C(S2)C(=O)[O-]

InChI

InChI=1S/C14H20O2S/c1-4-14(2,3)10-5-6-11-9(7-10)8-12(17-11)13(15)16/h8,10H,4-7H2,1-3H3,(H,15,16)/p-1/t10-/m0/s1