[(1S)-2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl] 5-ethanoylthiophene-2-carboxylate

Systemtic Name: [(1S)-2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl] 5-ethanoylthiophene-2-carboxylate Openeye Name: [(1S)-2-oxo-1-phenyl-2-(1-piperidyl)ethyl] 5-acetylthiophene-2-carboxylate CAS Name: 5-acetyl-2-thiophenecarboxylic acid [(1S)-2-oxo-1-phenyl-2-(1-piperidinyl)ethyl] ester IUPAC Name: [(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl] 5-acetylthiophene-2-carboxylate Traditional Name: 5-acetylthiophene-2-carboxylic acid [(1S)-2-keto-1-phenyl-2-piperidino-ethyl] ester Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(S1)C(=O)OC(C2=CC=CC=C2)C(=O)N3CCCCC3

Isomeric SMILES

CC(=O)C1=CC=C(S1)C(=O)O[C@@H](C2=CC=CC=C2)C(=O)N3CCCCC3

InChI

InChI=1S/C20H21NO4S/c1-14(22)16-10-11-17(26-16)20(24)25-18(15-8-4-2-5-9-15)19(23)21-12-6-3-7-13-21/h2,4-5,8-11,18H,3,6-7,12-13H2,1H3/t18-/m0/s1