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

Systemtic Name: 3-[4-(2,5-dimethylphenyl)carbonyl-2,3-bis(oxidanylidene)-5-phenyl-pyrrolidin-1-yl]propyl-dimethyl-azanium Openeye Name: 3-[4-(2,5-dimethylbenzoyl)-2,3-dioxo-5-phenyl-pyrrolidin-1-yl]propyl-dimethyl-ammonium CAS Name: 3-[4-[(2,5-dimethylphenyl)-oxomethyl]-2,3-dioxo-5-phenyl-1-pyrrolidinyl]propyl-dimethylammonium IUPAC Name: 3-[4-(2,5-dimethylbenzoyl)-2,3-dioxo-5-phenylpyrrolidin-1-yl]propyl-dimethylazanium Traditional Name: 3-[4-(2,5-dimethylbenzoyl)-2,3-diketo-5-phenyl-pyrrolidino]propyl-dimethyl-ammonium Formula: C24H29N2O3+ MolecularWeight: 393.49866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H28N2O3/c1-16-11-12-17(2)19(15-16)22(27)20-21(18-9-6-5-7-10-18)26(24(29)23(20)28)14-8-13-25(3)4/h5-7,9-12,15,20-21H,8,13-14H2,1-4H3/p+1