ethyl 1-[2-(2,3-dihydro-1,4-oxathiin-6-ylcarbonylamino)phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(2,3-dihydro-1,4-oxathiin-6-ylcarbonylamino)phenyl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[2-(2,3-dihydro-1,4-oxathiine-6-carbonylamino)benzoyl]piperidine-4-carboxylate CAS Name: 1-[[2-[[2,3-dihydro-1,4-oxathiin-6-yl(oxo)methyl]amino]phenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(2,3-dihydro-1,4-oxathiine-6-carbonylamino)benzoyl]piperidine-4-carboxylate Traditional Name: 1-[2-(2,3-dihydro-1,4-oxathiin-6-carbonylamino)benzoyl]isonipecotic acid ethyl ester Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3=CSCCO3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3=CSCCO3

InChI

InChI=1S/C20H24N2O5S/c1-2-26-20(25)14-7-9-22(10-8-14)19(24)15-5-3-4-6-16(15)21-18(23)17-13-28-12-11-27-17/h3-6,13-14H,2,7-12H2,1H3,(H,21,23)