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

Systemtic Name: 3-[2-(4-bromophenyl)-3-(4-methoxy-2-methyl-phenyl)carbonyl-4,5-bis(oxidanylidene)pyrrolidin-1-yl]propyl-dimethyl-azanium Openeye Name: 3-[2-(4-bromophenyl)-3-(4-methoxy-2-methyl-benzoyl)-4,5-dioxo-pyrrolidin-1-yl]propyl-dimethyl-ammonium CAS Name: 3-[2-(4-bromophenyl)-3-[(4-methoxy-2-methylphenyl)-oxomethyl]-4,5-dioxo-1-pyrrolidinyl]propyl-dimethylammonium IUPAC Name: 3-[2-(4-bromophenyl)-3-(4-methoxy-2-methylbenzoyl)-4,5-dioxopyrrolidin-1-yl]propyl-dimethylazanium Traditional Name: 3-[2-(4-bromophenyl)-4,5-diketo-3-(4-methoxy-2-methyl-benzoyl)pyrrolidino]propyl-dimethyl-ammonium Formula: C24H28BrN2O4+ MolecularWeight: 488.39412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)C(=O)C2C(N(C(=O)C2=O)CCC[NH+](C)C)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)OC)C(=O)C2C(N(C(=O)C2=O)CCC[NH+](C)C)C3=CC=C(C=C3)Br

InChI

InChI=1S/C24H27BrN2O4/c1-15-14-18(31-4)10-11-19(15)22(28)20-21(16-6-8-17(25)9-7-16)27(24(30)23(20)29)13-5-12-26(2)3/h6-11,14,20-21H,5,12-13H2,1-4H3/p+1