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

Systemtic Name: 5-(4-fluorophenyl)-4-(4-methoxy-3-methyl-phenyl)carbonyl-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolidine-2,3-dione Openeye Name: 5-(4-fluorophenyl)-4-(4-methoxy-3-methyl-benzoyl)-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolidine-2,3-dione CAS Name: 5-(4-fluorophenyl)-4-[(4-methoxy-3-methylphenyl)-oxomethyl]-1-[3-(4-morpholin-4-iumyl)propyl]pyrrolidine-2,3-dione IUPAC Name: 5-(4-fluorophenyl)-4-(4-methoxy-3-methylbenzoyl)-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolidine-2,3-dione Traditional Name: 5-(4-fluorophenyl)-4-(4-methoxy-3-methyl-benzoyl)-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolidine-2,3-quinone Formula: C26H30FN2O5+ MolecularWeight: 469.525203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)C2C(N(C(=O)C2=O)CCC[NH+]3CCOCC3)C4=CC=C(C=C4)F)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)C2C(N(C(=O)C2=O)CCC[NH+]3CCOCC3)C4=CC=C(C=C4)F)OC

InChI

InChI=1S/C26H29FN2O5/c1-17-16-19(6-9-21(17)33-2)24(30)22-23(18-4-7-20(27)8-5-18)29(26(32)25(22)31)11-3-10-28-12-14-34-15-13-28/h4-9,16,22-23H,3,10-15H2,1-2H3/p+1