2-[3-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]benzamide

Systemtic Name: 2-[3-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]benzamide Openeye Name: 2-[3-(4-nitro-1,3-dioxo-isoindolin-2-yl)propanoylamino]benzamide CAS Name: 2-[[3-(4-nitro-1,3-dioxo-2-isoindolyl)-1-oxopropyl]amino]benzamide IUPAC Name: 2-[3-(4-nitro-1,3-dioxoisoindol-2-yl)propanoylamino]benzamide Traditional Name: 2-[3-(1,3-diketo-4-nitro-isoindolin-2-yl)propanoylamino]benzamide Formula: C18H14N4O6 MolecularWeight: 382.32696

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)N)NC(=O)CCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)N)NC(=O)CCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H14N4O6/c19-16(24)10-4-1-2-6-12(10)20-14(23)8-9-21-17(25)11-5-3-7-13(22(27)28)15(11)18(21)26/h1-7H,8-9H2,(H2,19,24)(H,20,23)