[(1R)-1-cyanoethyl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: [(1R)-1-cyanoethyl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: [(1R)-1-cyanoethyl] 2-acetamido-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-acetamido-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid [(1R)-1-cyanoethyl] ester Formula: C14H16N2O3S MolecularWeight: 292.35344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)C1=C(SC2=C1CCCC2)NC(=O)C

Isomeric SMILES

C[C@H](C#N)OC(=O)C1=C(SC2=C1CCCC2)NC(=O)C

InChI

InChI=1S/C14H16N2O3S/c1-8(7-15)19-14(18)12-10-5-3-4-6-11(10)20-13(12)16-9(2)17/h8H,3-6H2,1-2H3,(H,16,17)/t8-/m1/s1