3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-methoxy-5-nitro-phenyl)propanamide

Systemtic Name: 3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-methoxy-5-nitro-phenyl)propanamide Openeye Name: 3-(5-bromo-1,3-dioxo-isoindolin-2-yl)-N-(2-methoxy-5-nitro-phenyl)propanamide CAS Name: 3-(5-bromo-1,3-dioxo-2-isoindolyl)-N-(2-methoxy-5-nitrophenyl)propanamide IUPAC Name: 3-(5-bromo-1,3-dioxoisoindol-2-yl)-N-(2-methoxy-5-nitrophenyl)propanamide Traditional Name: 3-(5-bromo-1,3-diketo-isoindolin-2-yl)-N-(2-methoxy-5-nitro-phenyl)propionamide Formula: C18H14BrN3O6 MolecularWeight: 448.22426

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CCN2C(=O)C3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CCN2C(=O)C3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C18H14BrN3O6/c1-28-15-5-3-11(22(26)27)9-14(15)20-16(23)6-7-21-17(24)12-4-2-10(19)8-13(12)18(21)25/h2-5,8-9H,6-7H2,1H3,(H,20,23)