(3R)-1-(4-fluorophenyl)-3-(4-pyrazin-2-ylpiperazin-1-ium-1-yl)pyrrolidine-2,5-dione

Systemtic Name: (3R)-1-(4-fluorophenyl)-3-(4-pyrazin-2-ylpiperazin-1-ium-1-yl)pyrrolidine-2,5-dione Openeye Name: (3R)-1-(4-fluorophenyl)-3-(4-pyrazin-2-ylpiperazin-1-ium-1-yl)pyrrolidine-2,5-dione CAS Name: (3R)-1-(4-fluorophenyl)-3-[4-(2-pyrazinyl)-1-piperazin-1-iumyl]pyrrolidine-2,5-dione IUPAC Name: (3R)-1-(4-fluorophenyl)-3-(4-pyrazin-2-ylpiperazin-1-ium-1-yl)pyrrolidine-2,5-dione Traditional Name: (3R)-1-(4-fluorophenyl)-3-(4-pyrazin-2-ylpiperazin-1-ium-1-yl)pyrrolidine-2,5-quinone Formula: C18H19FN5O2+ MolecularWeight: 356.374163

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C2CC(=O)N(C2=O)C3=CC=C(C=C3)F)C4=NC=CN=C4

Isomeric SMILES

C1CN(CC[NH+]1[C@@H]2CC(=O)N(C2=O)C3=CC=C(C=C3)F)C4=NC=CN=C4

InChI

InChI=1S/C18H18FN5O2/c19-13-1-3-14(4-2-13)24-17(25)11-15(18(24)26)22-7-9-23(10-8-22)16-12-20-5-6-21-16/h1-6,12,15H,7-11H2/p+1/t15-/m1/s1