N-[[2-(diethylamino)pyridin-1-ium-3-yl]methyl]-2-[(1R)-3-oxidanylidene-1,2-dihydroisoindol-1-yl]ethanamide

Systemtic Name: N-[[2-(diethylamino)pyridin-1-ium-3-yl]methyl]-2-[(1R)-3-oxidanylidene-1,2-dihydroisoindol-1-yl]ethanamide Openeye Name: N-[[2-(diethylamino)pyridin-1-ium-3-yl]methyl]-2-[(1R)-3-oxoisoindolin-1-yl]acetamide CAS Name: N-[[2-(diethylamino)-3-pyridin-1-iumyl]methyl]-2-[(1R)-3-oxo-1,2-dihydroisoindol-1-yl]acetamide IUPAC Name: N-[[2-(diethylamino)pyridin-1-ium-3-yl]methyl]-2-[(1R)-3-oxo-1,2-dihydroisoindol-1-yl]acetamide Traditional Name: N-[[2-(diethylamino)pyridin-1-ium-3-yl]methyl]-2-[(1R)-3-ketoisoindolin-1-yl]acetamide Formula: C20H25N4O2+ MolecularWeight: 353.4381

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=CC=[NH+]1)CNC(=O)CC2C3=CC=CC=C3C(=O)N2

Isomeric SMILES

CCN(CC)C1=C(C=CC=[NH+]1)CNC(=O)C[C@@H]2C3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C20H24N4O2/c1-3-24(4-2)19-14(8-7-11-21-19)13-22-18(25)12-17-15-9-5-6-10-16(15)20(26)23-17/h5-11,17H,3-4,12-13H2,1-2H3,(H,22,25)(H,23,26)/p+1/t17-/m1/s1