ethyl (3S)-1-(2-benzo[e][1]benzofuran-1-ylethanoyl)piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-(2-benzo[e][1]benzofuran-1-ylethanoyl)piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-(2-benzo[e]benzofuran-1-ylacetyl)piperidine-3-carboxylate CAS Name: (3S)-1-[2-(1-benzo[e]benzofuranyl)-1-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-(2-benzo[e][1]benzofuran-1-ylacetyl)piperidine-3-carboxylate Traditional Name: (3S)-1-(2-benzo[e]benzofuran-1-ylacetyl)nipecotic acid ethyl ester Formula: C22H23NO4 MolecularWeight: 365.42232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CC2=COC3=C2C4=CC=CC=C4C=C3

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)C(=O)CC2=COC3=C2C4=CC=CC=C4C=C3

InChI

InChI=1S/C22H23NO4/c1-2-26-22(25)16-7-5-11-23(13-16)20(24)12-17-14-27-19-10-9-15-6-3-4-8-18(15)21(17)19/h3-4,6,8-10,14,16H,2,5,7,11-13H2,1H3/t16-/m0/s1