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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC=CC=C2NC(=O)C3=CSCCO3

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CC=CC=C2NC(=O)C3=CSCCO3

InChI

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