(3R)-3-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-1-propan-2-yl-pyrrolidine-2,5-dione

Systemtic Name: (3R)-3-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-1-propan-2-yl-pyrrolidine-2,5-dione Openeye Name: (3R)-3-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-1-isopropyl-pyrrolidine-2,5-dione CAS Name: (3R)-3-[4-(4-fluorophenyl)-1-piperazin-1-iumyl]-1-propan-2-ylpyrrolidine-2,5-dione IUPAC Name: (3R)-3-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-1-propan-2-ylpyrrolidine-2,5-dione Traditional Name: (3R)-3-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-1-isopropyl-pyrrolidine-2,5-quinone Formula: C17H23FN3O2+ MolecularWeight: 320.381823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)CC(C1=O)[NH+]2CCN(CC2)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)N1C(=O)C[C@H](C1=O)[NH+]2CCN(CC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H22FN3O2/c1-12(2)21-16(22)11-15(17(21)23)20-9-7-19(8-10-20)14-5-3-13(18)4-6-14/h3-6,12,15H,7-11H2,1-2H3/p+1/t15-/m1/s1