N-[2-methyl-1,3-bis(oxidanylidene)isoindol-5-yl]-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-[2-methyl-1,3-bis(oxidanylidene)isoindol-5-yl]-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-(2-methyl-1,3-dioxo-isoindolin-5-yl)-4-morpholino-3-nitro-benzamide CAS Name: N-(2-methyl-1,3-dioxo-5-isoindolyl)-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-(2-methyl-1,3-dioxoisoindol-5-yl)-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-(1,3-diketo-2-methyl-isoindolin-5-yl)-4-morpholino-3-nitro-benzamide Formula: C20H18N4O6 MolecularWeight: 410.38012

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C1=O)C=C(C=C2)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CN1C(=O)C2=C(C1=O)C=C(C=C2)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O6/c1-22-19(26)14-4-3-13(11-15(14)20(22)27)21-18(25)12-2-5-16(17(10-12)24(28)29)23-6-8-30-9-7-23/h2-5,10-11H,6-9H2,1H3,(H,21,25)