2-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]-4-nitro-isoindole-1,3-dione Openeye Name: 2-[2-(3,4-dimethoxyphenyl)-2-oxo-ethyl]-4-nitro-isoindoline-1,3-dione CAS Name: 2-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-4-nitroisoindole-1,3-dione IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-4-nitroisoindole-1,3-dione Traditional Name: 2-[2-(3,4-dimethoxyphenyl)-2-keto-ethyl]-4-nitro-isoindoline-1,3-quinone Formula: C18H14N2O7 MolecularWeight: 370.31296

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C18H14N2O7/c1-26-14-7-6-10(8-15(14)27-2)13(21)9-19-17(22)11-4-3-5-12(20(24)25)16(11)18(19)23/h3-8H,9H2,1-2H3