1-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]-N,N-diethyl-pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]-N,N-diethyl-pyridin-1-ium-3-carboxamide Openeye Name: 1-[2-(1,3-dioxoisoindolin-2-yl)ethyl]-N,N-diethyl-pyridin-1-ium-3-carboxamide CAS Name: 1-[2-(1,3-dioxo-2-isoindolyl)ethyl]-N,N-diethyl-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[2-(1,3-dioxoisoindol-2-yl)ethyl]-N,N-diethylpyridin-1-ium-3-carboxamide Traditional Name: N,N-diethyl-1-(2-phthalimidoethyl)pyridin-1-ium-3-carboxamide Formula: C20H22N3O3+ MolecularWeight: 352.40698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N3O3/c1-3-22(4-2)18(24)15-8-7-11-21(14-15)12-13-23-19(25)16-9-5-6-10-17(16)20(23)26/h5-11,14H,3-4,12-13H2,1-2H3/q+1