[(1R)-2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl] 1-benzofuran-2-carboxylate

Systemtic Name: [(1R)-2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl] 1-benzofuran-2-carboxylate Openeye Name: [(1R)-2-oxo-1-phenyl-2-(1-piperidyl)ethyl] benzofuran-2-carboxylate CAS Name: 2-benzofurancarboxylic acid [(1R)-2-oxo-1-phenyl-2-(1-piperidinyl)ethyl] ester IUPAC Name: [(1R)-2-oxo-1-phenyl-2-piperidin-1-ylethyl] 1-benzofuran-2-carboxylate Traditional Name: coumarilic acid [(1R)-2-keto-1-phenyl-2-piperidino-ethyl] ester Formula: C22H21NO4 MolecularWeight: 363.40644

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(C2=CC=CC=C2)OC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

C1CCN(CC1)C(=O)[C@@H](C2=CC=CC=C2)OC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C22H21NO4/c24-21(23-13-7-2-8-14-23)20(16-9-3-1-4-10-16)27-22(25)19-15-17-11-5-6-12-18(17)26-19/h1,3-6,9-12,15,20H,2,7-8,13-14H2/t20-/m1/s1