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

Systemtic Name: [(1R)-2-oxidanylidenecyclohexyl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: [(1R)-2-oxocyclohexyl] 2-acetamido-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid [(1R)-2-oxocyclohexyl] ester IUPAC Name: [(1R)-2-oxocyclohexyl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-acetamido-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid [(1R)-2-ketocyclohexyl] ester Formula: C17H21NO4S MolecularWeight: 335.41794

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C2=C(S1)CCCC2)C(=O)OC3CCCCC3=O

Isomeric SMILES

CC(=O)NC1=C(C2=C(S1)CCCC2)C(=O)O[C@@H]3CCCCC3=O

InChI

InChI=1S/C17H21NO4S/c1-10(19)18-16-15(11-6-2-5-9-14(11)23-16)17(21)22-13-8-4-3-7-12(13)20/h13H,2-9H2,1H3,(H,18,19)/t13-/m1/s1