ethyl 4-[2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-(4-nitro-1,3-dioxo-isoindolin-2-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(4-nitro-1,3-dioxo-2-isoindolyl)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(4-nitro-1,3-dioxoisoindol-2-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(1,3-diketo-4-nitro-isoindolin-2-yl)acetyl]amino]benzoic acid ethyl ester Formula: C19H15N3O7 MolecularWeight: 397.3383

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15N3O7/c1-2-29-19(26)11-6-8-12(9-7-11)20-15(23)10-21-17(24)13-4-3-5-14(22(27)28)16(13)18(21)25/h3-9H,2,10H2,1H3,(H,20,23)