3-[4-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]pyridin-1-ium-1-yl]propyl-trimethyl-azanium

Systemtic Name: 3-[4-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]pyridin-1-ium-1-yl]propyl-trimethyl-azanium Openeye Name: 3-[4-[2-(1,3-dioxoisoindolin-2-yl)ethyl]pyridin-1-ium-1-yl]propyl-trimethyl-ammonium CAS Name: 3-[4-[2-(1,3-dioxo-2-isoindolyl)ethyl]-1-pyridin-1-iumyl]propyl-trimethylammonium IUPAC Name: 3-[4-[2-(1,3-dioxoisoindol-2-yl)ethyl]pyridin-1-ium-1-yl]propyl-trimethylazanium Traditional Name: trimethyl-[3-[4-(2-phthalimidoethyl)pyridin-1-ium-1-yl]propyl]ammonium Formula: C21H27N3O2+2 MolecularWeight: 353.45798

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCC[N+]1=CC=C(C=C1)CCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C[N+](C)(C)CCC[N+]1=CC=C(C=C1)CCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H27N3O2/c1-24(2,3)16-6-12-22-13-9-17(10-14-22)11-15-23-20(25)18-7-4-5-8-19(18)21(23)26/h4-5,7-10,13-14H,6,11-12,15-16H2,1-3H3/q+2