N-(5-chloranyl-2-morpholin-4-yl-phenyl)-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide

Systemtic Name: N-(5-chloranyl-2-morpholin-4-yl-phenyl)-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide Openeye Name: N-(5-chloro-2-morpholino-phenyl)-2-(4-nitro-1,3-dioxo-isoindolin-2-yl)acetamide CAS Name: N-[5-chloro-2-(4-morpholinyl)phenyl]-2-(4-nitro-1,3-dioxo-2-isoindolyl)acetamide IUPAC Name: N-(5-chloro-2-morpholin-4-ylphenyl)-2-(4-nitro-1,3-dioxoisoindol-2-yl)acetamide Traditional Name: N-(5-chloro-2-morpholino-phenyl)-2-(1,3-diketo-4-nitro-isoindolin-2-yl)acetamide Formula: C20H17ClN4O6 MolecularWeight: 444.82518

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)Cl)NC(=O)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)Cl)NC(=O)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H17ClN4O6/c21-12-4-5-15(23-6-8-31-9-7-23)14(10-12)22-17(26)11-24-19(27)13-2-1-3-16(25(29)30)18(13)20(24)28/h1-5,10H,6-9,11H2,(H,22,26)