2-(4,6-dimethylpyridin-2-yl)-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-(4,6-dimethylpyridin-2-yl)-4-nitro-isoindole-1,3-dione Openeye Name: 2-(4,6-dimethyl-2-pyridyl)-4-nitro-isoindoline-1,3-dione CAS Name: 2-(4,6-dimethyl-2-pyridinyl)-4-nitroisoindole-1,3-dione IUPAC Name: 2-(4,6-dimethylpyridin-2-yl)-4-nitroisoindole-1,3-dione Traditional Name: 2-(4,6-dimethyl-2-pyridyl)-4-nitro-isoindoline-1,3-quinone Formula: C15H11N3O4 MolecularWeight: 297.26554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11N3O4/c1-8-6-9(2)16-12(7-8)17-14(19)10-4-3-5-11(18(21)22)13(10)15(17)20/h3-7H,1-2H3