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

Systemtic Name: 4-(4-fluorophenyl)carbonyl-5-(3-methoxyphenyl)-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolidine-2,3-dione Openeye Name: 4-(4-fluorobenzoyl)-5-(3-methoxyphenyl)-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolidine-2,3-dione CAS Name: 4-[(4-fluorophenyl)-oxomethyl]-5-(3-methoxyphenyl)-1-[3-(4-morpholin-4-iumyl)propyl]pyrrolidine-2,3-dione IUPAC Name: 4-(4-fluorobenzoyl)-5-(3-methoxyphenyl)-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolidine-2,3-dione Traditional Name: 4-(4-fluorobenzoyl)-5-(3-methoxyphenyl)-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolidine-2,3-quinone Formula: C25H28FN2O5+ MolecularWeight: 455.498623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2C(C(=O)C(=O)N2CCC[NH+]3CCOCC3)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=CC(=C1)C2C(C(=O)C(=O)N2CCC[NH+]3CCOCC3)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H27FN2O5/c1-32-20-5-2-4-18(16-20)22-21(23(29)17-6-8-19(26)9-7-17)24(30)25(31)28(22)11-3-10-27-12-14-33-15-13-27/h2,4-9,16,21-22H,3,10-15H2,1H3/p+1