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

Systemtic Name: (3S)-3-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-1-naphthalen-1-yl-pyrrolidine-2,5-dione Openeye Name: (3S)-3-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-1-(1-naphthyl)pyrrolidine-2,5-dione CAS Name: (3S)-3-[4-(4-fluorophenyl)-1-piperazin-1-iumyl]-1-(1-naphthalenyl)pyrrolidine-2,5-dione IUPAC Name: (3S)-3-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-1-naphthalen-1-ylpyrrolidine-2,5-dione Traditional Name: (3S)-3-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-1-(1-naphthyl)pyrrolidine-2,5-quinone Formula: C24H23FN3O2+ MolecularWeight: 404.456723

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C2CC(=O)N(C2=O)C3=CC=CC4=CC=CC=C43)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CC[NH+]1[C@H]2CC(=O)N(C2=O)C3=CC=CC4=CC=CC=C43)C5=CC=C(C=C5)F

InChI

InChI=1S/C24H22FN3O2/c25-18-8-10-19(11-9-18)26-12-14-27(15-13-26)22-16-23(29)28(24(22)30)21-7-3-5-17-4-1-2-6-20(17)21/h1-11,22H,12-16H2/p+1/t22-/m0/s1