3-[3-(4-ethoxy-3-methyl-phenyl)carbonyl-2-(2-fluorophenyl)-4,5-bis(oxidanylidene)pyrrolidin-1-yl]propyl-dimethyl-azanium

Systemtic Name: 3-[3-(4-ethoxy-3-methyl-phenyl)carbonyl-2-(2-fluorophenyl)-4,5-bis(oxidanylidene)pyrrolidin-1-yl]propyl-dimethyl-azanium Openeye Name: 3-[3-(4-ethoxy-3-methyl-benzoyl)-2-(2-fluorophenyl)-4,5-dioxo-pyrrolidin-1-yl]propyl-dimethyl-ammonium CAS Name: 3-[3-[(4-ethoxy-3-methylphenyl)-oxomethyl]-2-(2-fluorophenyl)-4,5-dioxo-1-pyrrolidinyl]propyl-dimethylammonium IUPAC Name: 3-[3-(4-ethoxy-3-methylbenzoyl)-2-(2-fluorophenyl)-4,5-dioxopyrrolidin-1-yl]propyl-dimethylazanium Traditional Name: 3-[3-(4-ethoxy-3-methyl-benzoyl)-2-(2-fluorophenyl)-4,5-diketo-pyrrolidino]propyl-dimethyl-ammonium Formula: C25H30FN2O4+ MolecularWeight: 441.515103

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C2C(N(C(=O)C2=O)CCC[NH+](C)C)C3=CC=CC=C3F)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C2C(N(C(=O)C2=O)CCC[NH+](C)C)C3=CC=CC=C3F)C

InChI

InChI=1S/C25H29FN2O4/c1-5-32-20-12-11-17(15-16(20)2)23(29)21-22(18-9-6-7-10-19(18)26)28(25(31)24(21)30)14-8-13-27(3)4/h6-7,9-12,15,21-22H,5,8,13-14H2,1-4H3/p+1