2-(4-methylpyridin-2-yl)-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-(4-methylpyridin-2-yl)-5-nitro-isoindole-1,3-dione Openeye Name: 2-(4-methyl-2-pyridyl)-5-nitro-isoindoline-1,3-dione CAS Name: 2-(4-methyl-2-pyridinyl)-5-nitroisoindole-1,3-dione IUPAC Name: 2-(4-methylpyridin-2-yl)-5-nitroisoindole-1,3-dione Traditional Name: 2-(4-methyl-2-pyridyl)-5-nitro-isoindoline-1,3-quinone Formula: C14H9N3O4 MolecularWeight: 283.23896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NC=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H9N3O4/c1-8-4-5-15-12(6-8)16-13(18)10-3-2-9(17(20)21)7-11(10)14(16)19/h2-7H,1H3