2-[[4-(dimethylamino)pyridin-1-ium-1-yl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[4-(dimethylamino)pyridin-1-ium-1-yl]methyl]isoindole-1,3-dione Openeye Name: 2-[[4-(dimethylamino)pyridin-1-ium-1-yl]methyl]isoindoline-1,3-dione CAS Name: 2-[[4-(dimethylamino)-1-pyridin-1-iumyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[4-(dimethylamino)pyridin-1-ium-1-yl]methyl]isoindole-1,3-dione Traditional Name: 2-[[4-(dimethylamino)pyridin-1-ium-1-yl]methyl]isoindoline-1,3-quinone Formula: C16H16N3O2+ MolecularWeight: 282.31714

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=[N+](C=C1)CN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CN(C)C1=CC=[N+](C=C1)CN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C16H16N3O2/c1-17(2)12-7-9-18(10-8-12)11-19-15(20)13-5-3-4-6-14(13)16(19)21/h3-10H,11H2,1-2H3/q+1