(4R)-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)carbonyl-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one

Systemtic Name: (4R)-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)carbonyl-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one Openeye Name: (4R)-4-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one CAS Name: (4R)-4-[oxo-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methyl]-1-[3-(trifluoromethyl)phenyl]-2-pyrrolidinone IUPAC Name: (4R)-4-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one Traditional Name: (4R)-4-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)-1-[3-(trifluoromethyl)phenyl]-2-pyrrolidone Formula: C21H22F3N4O2+ MolecularWeight: 419.42019

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3CC(=O)N(C3)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)[C@@H]3CC(=O)N(C3)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C21H21F3N4O2/c22-21(23,24)16-4-3-5-17(13-16)28-14-15(12-19(28)29)20(30)27-10-8-26(9-11-27)18-6-1-2-7-25-18/h1-7,13,15H,8-12,14H2/p+1/t15-/m1/s1