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

Systemtic Name: (3S)-1-(4-fluorophenyl)-3-[4-[(4-fluorophenyl)amino]piperidin-1-ium-1-yl]pyrrolidine-2,5-dione Openeye Name: (3S)-3-[4-(4-fluoroanilino)piperidin-1-ium-1-yl]-1-(4-fluorophenyl)pyrrolidine-2,5-dione CAS Name: (3S)-3-[4-(4-fluoroanilino)-1-piperidin-1-iumyl]-1-(4-fluorophenyl)pyrrolidine-2,5-dione IUPAC Name: (3S)-3-[4-(4-fluoroanilino)piperidin-1-ium-1-yl]-1-(4-fluorophenyl)pyrrolidine-2,5-dione Traditional Name: (3S)-3-[4-(4-fluoroanilino)piperidin-1-ium-1-yl]-1-(4-fluorophenyl)pyrrolidine-2,5-quinone Formula: C21H22F2N3O2+ MolecularWeight: 386.415086

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC2=CC=C(C=C2)F)C3CC(=O)N(C3=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1C[NH+](CCC1NC2=CC=C(C=C2)F)[C@H]3CC(=O)N(C3=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H21F2N3O2/c22-14-1-5-16(6-2-14)24-17-9-11-25(12-10-17)19-13-20(27)26(21(19)28)18-7-3-15(23)4-8-18/h1-8,17,19,24H,9-13H2/p+1/t19-/m0/s1