2-[2-(3,4-dimethylphenyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonyloxyethyl-dimethyl-azanium

Systemtic Name: 2-[2-(3,4-dimethylphenyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonyloxyethyl-dimethyl-azanium Openeye Name: 2-[2-(3,4-dimethylphenyl)-1,3-dioxo-isoindoline-5-carbonyl]oxyethyl-dimethyl-ammonium CAS Name: 2-[[2-(3,4-dimethylphenyl)-1,3-dioxo-5-isoindolyl]-oxomethoxy]ethyl-dimethylammonium IUPAC Name: 2-[2-(3,4-dimethylphenyl)-1,3-dioxoisoindole-5-carbonyl]oxyethyl-dimethylazanium Traditional Name: 2-[2-(3,4-dimethylphenyl)-1,3-diketo-isoindoline-5-carbonyl]oxyethyl-dimethyl-ammonium Formula: C21H23N2O4+ MolecularWeight: 367.41832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC[NH+](C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC[NH+](C)C)C

InChI

InChI=1S/C21H22N2O4/c1-13-5-7-16(11-14(13)2)23-19(24)17-8-6-15(12-18(17)20(23)25)21(26)27-10-9-22(3)4/h5-8,11-12H,9-10H2,1-4H3/p+1