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

Systemtic Name: (2R)-N-cyclohexyl-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-N-cyclohexyl-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-ium-1-yl]propanamide CAS Name: (2R)-N-cyclohexyl-2-[4-[3-(trifluoromethyl)phenyl]-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-cyclohexyl-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-cyclohexyl-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-ium-1-yl]propionamide Formula: C20H29F3N3O+ MolecularWeight: 384.45897

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCC1)[NH+]2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C[C@H](C(=O)NC1CCCCC1)[NH+]2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C20H28F3N3O/c1-15(19(27)24-17-7-3-2-4-8-17)25-10-12-26(13-11-25)18-9-5-6-16(14-18)20(21,22)23/h5-6,9,14-15,17H,2-4,7-8,10-13H2,1H3,(H,24,27)/p+1/t15-/m1/s1