4-(4-fluorophenyl)carbonyl-5-(4-methylphenyl)-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolidine-2,3-dione

Systemtic Name: 4-(4-fluorophenyl)carbonyl-5-(4-methylphenyl)-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolidine-2,3-dione Openeye Name: 4-(4-fluorobenzoyl)-1-(3-morpholin-4-ium-4-ylpropyl)-5-(p-tolyl)pyrrolidine-2,3-dione CAS Name: 4-[(4-fluorophenyl)-oxomethyl]-5-(4-methylphenyl)-1-[3-(4-morpholin-4-iumyl)propyl]pyrrolidine-2,3-dione IUPAC Name: 4-(4-fluorobenzoyl)-5-(4-methylphenyl)-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolidine-2,3-dione Traditional Name: 4-(4-fluorobenzoyl)-1-(3-morpholin-4-ium-4-ylpropyl)-5-(p-tolyl)pyrrolidine-2,3-quinone Formula: C25H28FN2O4+ MolecularWeight: 439.499223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(C(=O)C(=O)N2CCC[NH+]3CCOCC3)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=C(C=C1)C2C(C(=O)C(=O)N2CCC[NH+]3CCOCC3)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H27FN2O4/c1-17-3-5-18(6-4-17)22-21(23(29)19-7-9-20(26)10-8-19)24(30)25(31)28(22)12-2-11-27-13-15-32-16-14-27/h3-10,21-22H,2,11-16H2,1H3/p+1