methyl (5S)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

Systemtic Name: methyl (5S)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Openeye Name: methyl (5S)-5-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxylate CAS Name: (5S)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl (5S)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Traditional Name: (5S)-5-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid methyl ester Formula: C14H20O2S MolecularWeight: 252.3724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)OC

Isomeric SMILES

CC(C)(C)[C@H]1CCC2=C(C1)C=C(S2)C(=O)OC

InChI

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