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

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide Openeye Name: N-(4-chloro-2,5-dimethoxy-phenyl)-2-(5-nitro-1,3-dioxo-isoindolin-2-yl)acetamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-2-(5-nitro-1,3-dioxo-2-isoindolyl)acetamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-2-(5-nitro-1,3-dioxoisoindol-2-yl)acetamide Traditional Name: N-(4-chloro-2,5-dimethoxy-phenyl)-2-(1,3-diketo-5-nitro-isoindolin-2-yl)acetamide Formula: C18H14ClN3O7 MolecularWeight: 419.77266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])OC)Cl

InChI

InChI=1S/C18H14ClN3O7/c1-28-14-7-13(15(29-2)6-12(14)19)20-16(23)8-21-17(24)10-4-3-9(22(26)27)5-11(10)18(21)25/h3-7H,8H2,1-2H3,(H,20,23)