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

Systemtic Name: 2-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]isoindole-1,3-dione Openeye Name: 2-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]isoindoline-1,3-dione CAS Name: 2-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]isoindole-1,3-dione Traditional Name: 2-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]isoindoline-1,3-quinone Formula: C18H16N2O6 MolecularWeight: 356.32944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCN2C(=O)C3=CC=CC=C3C2=O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCN2C(=O)C3=CC=CC=C3C2=O)[N+](=O)[O-])OC

InChI

InChI=1S/C18H16N2O6/c1-25-15-9-11(14(20(23)24)10-16(15)26-2)7-8-19-17(21)12-5-3-4-6-13(12)18(19)22/h3-6,9-10H,7-8H2,1-2H3