(6S)-2-acetamido-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid

Systemtic Name: (6S)-2-acetamido-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid Openeye Name: (6S)-2-acetamido-6-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid CAS Name: (6S)-2-acetamido-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid IUPAC Name: (6S)-2-acetamido-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid Traditional Name: (6S)-2-acetamido-6-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid Formula: C15H21NO3S MolecularWeight: 295.39714

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C2=C(S1)CC(CC2)C(C)(C)C)C(=O)O

Isomeric SMILES

CC(=O)NC1=C(C2=C(S1)C[C@H](CC2)C(C)(C)C)C(=O)O

InChI

InChI=1S/C15H21NO3S/c1-8(17)16-13-12(14(18)19)10-6-5-9(15(2,3)4)7-11(10)20-13/h9H,5-7H2,1-4H3,(H,16,17)(H,18,19)/t9-/m0/s1