(2R)-2-(4-phenylpiperazin-1-ium-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide

Systemtic Name: (2R)-2-(4-phenylpiperazin-1-ium-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide Openeye Name: (2R)-2-(4-phenylpiperazin-1-ium-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide CAS Name: (2R)-2-(4-phenyl-1-piperazin-1-iumyl)-N-[3-(trifluoromethyl)phenyl]propanamide IUPAC Name: (2R)-2-(4-phenylpiperazin-1-ium-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide Traditional Name: (2R)-2-(4-phenylpiperazin-1-ium-1-yl)-N-[3-(trifluoromethyl)phenyl]propionamide Formula: C20H23F3N3O+ MolecularWeight: 378.41133

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C(F)(F)F)[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC(=C1)C(F)(F)F)[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C20H22F3N3O/c1-15(19(27)24-17-7-5-6-16(14-17)20(21,22)23)25-10-12-26(13-11-25)18-8-3-2-4-9-18/h2-9,14-15H,10-13H2,1H3,(H,24,27)/p+1/t15-/m1/s1