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

Systemtic Name: (2R)-N-aminocarbonyl-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-N-carbamoyl-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-ium-1-yl]propanamide CAS Name: (2R)-N-carbamoyl-2-[4-[3-(trifluoromethyl)phenyl]-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-carbamoyl-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-carbamoyl-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-ium-1-yl]propionamide Formula: C15H20F3N4O2+ MolecularWeight: 345.34011

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)[NH+]1CCN(CC1)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

C[C@H](C(=O)NC(=O)N)[NH+]1CCN(CC1)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C15H19F3N4O2/c1-10(13(23)20-14(19)24)21-5-7-22(8-6-21)12-4-2-3-11(9-12)15(16,17)18/h2-4,9-10H,5-8H2,1H3,(H3,19,20,23,24)/p+1/t10-/m1/s1