5-phenyl-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide

Systemtic Name: 5-phenyl-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: 5-phenyl-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: 5-phenyl-N-[(2R)-2-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: 5-phenyl-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-ylethyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: 5-phenyl-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C23H27N2O2S+ MolecularWeight: 395.53768

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=O)C2=C(SCCO2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CNC(=O)C2=C(SCCO2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H26N2O2S/c26-23(21-22(28-16-15-27-21)19-11-5-2-6-12-19)24-17-20(25-13-7-8-14-25)18-9-3-1-4-10-18/h1-6,9-12,20H,7-8,13-17H2,(H,24,26)/p+1/t20-/m0/s1