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

Systemtic Name: N-(5-chloranyl-2-cyano-phenyl)-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide Openeye Name: N-(5-chloro-2-cyano-phenyl)-2-(4-nitro-1,3-dioxo-isoindolin-2-yl)acetamide CAS Name: N-(5-chloro-2-cyanophenyl)-2-(4-nitro-1,3-dioxo-2-isoindolyl)acetamide IUPAC Name: N-(5-chloro-2-cyanophenyl)-2-(4-nitro-1,3-dioxoisoindol-2-yl)acetamide Traditional Name: N-(5-chloro-2-cyano-phenyl)-2-(1,3-diketo-4-nitro-isoindolin-2-yl)acetamide Formula: C17H9ClN4O5 MolecularWeight: 384.73016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)N(C2=O)CC(=O)NC3=C(C=CC(=C3)Cl)C#N

Isomeric SMILES

C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)N(C2=O)CC(=O)NC3=C(C=CC(=C3)Cl)C#N

InChI

InChI=1S/C17H9ClN4O5/c18-10-5-4-9(7-19)12(6-10)20-14(23)8-21-16(24)11-2-1-3-13(22(26)27)15(11)17(21)25/h1-6H,8H2,(H,20,23)