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

Systemtic Name: (3R)-1-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-3-phenyl-pyrrolidine-2,5-dione Openeye Name: (3R)-1-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-3-phenyl-pyrrolidine-2,5-dione CAS Name: (3R)-1-[[4-(4-fluorophenyl)-1-piperazin-1-iumyl]methyl]-3-phenylpyrrolidine-2,5-dione IUPAC Name: (3R)-1-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-3-phenylpyrrolidine-2,5-dione Traditional Name: (3R)-1-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-3-phenyl-pyrrolidine-2,5-quinone Formula: C21H23FN3O2+ MolecularWeight: 368.424623

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CN2C(=O)CC(C2=O)C3=CC=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CC[NH+]1CN2C(=O)C[C@@H](C2=O)C3=CC=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H22FN3O2/c22-17-6-8-18(9-7-17)24-12-10-23(11-13-24)15-25-20(26)14-19(21(25)27)16-4-2-1-3-5-16/h1-9,19H,10-15H2/p+1/t19-/m1/s1