dimethyl 2-[2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[2-(4-nitro-1,3-dioxo-isoindolin-2-yl)acetyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[2-(4-nitro-1,3-dioxo-2-isoindolyl)-1-oxoethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[2-(4-nitro-1,3-dioxoisoindol-2-yl)acetyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[2-(1,3-diketo-4-nitro-isoindolin-2-yl)acetyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C20H15N3O9 MolecularWeight: 441.3478

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15N3O9/c1-31-19(27)10-6-7-11(20(28)32-2)13(8-10)21-15(24)9-22-17(25)12-4-3-5-14(23(29)30)16(12)18(22)26/h3-8H,9H2,1-2H3,(H,21,24)