2-[(4,5-dimethoxy-2-nitro-phenyl)methyl]isoindole-1,3-dione

Systemtic Name: 2-[(4,5-dimethoxy-2-nitro-phenyl)methyl]isoindole-1,3-dione Openeye Name: 2-[(4,5-dimethoxy-2-nitro-phenyl)methyl]isoindoline-1,3-dione CAS Name: 2-[(4,5-dimethoxy-2-nitrophenyl)methyl]isoindole-1,3-dione IUPAC Name: 2-[(4,5-dimethoxy-2-nitrophenyl)methyl]isoindole-1,3-dione Traditional Name: 2-(4,5-dimethoxy-2-nitro-benzyl)isoindoline-1,3-quinone Formula: C17H14N2O6 MolecularWeight: 342.30286

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CN2C(=O)C3=CC=CC=C3C2=O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CN2C(=O)C3=CC=CC=C3C2=O)[N+](=O)[O-])OC

InChI

InChI=1S/C17H14N2O6/c1-24-14-7-10(13(19(22)23)8-15(14)25-2)9-18-16(20)11-5-3-4-6-12(11)17(18)21/h3-8H,9H2,1-2H3