(3S)-1-(4-fluorophenyl)sulfonyl-N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]piperidine-3-carboxamide Openeye Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]piperidine-3-carboxamide CAS Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[(1R)-2-(4-morpholin-4-iumyl)-1-phenylethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]piperidine-3-carboxamide Traditional Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]nipecotamide Formula: C24H31FN3O4S+ MolecularWeight: 476.584043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NC(C[NH+]3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)N[C@@H](C[NH+]3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C24H30FN3O4S/c25-21-8-10-22(11-9-21)33(30,31)28-12-4-7-20(17-28)24(29)26-23(19-5-2-1-3-6-19)18-27-13-15-32-16-14-27/h1-3,5-6,8-11,20,23H,4,7,12-18H2,(H,26,29)/p+1/t20-,23-/m0/s1