[2-(4-nitrophenyl)-2-oxidanylidene-ethyl] 2-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoate

Systemtic Name: [2-(4-nitrophenyl)-2-oxidanylidene-ethyl] 2-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoate Openeye Name: [2-(4-nitrophenyl)-2-oxo-ethyl] 2-(5-bromo-1,3-dioxo-isoindolin-2-yl)acetate CAS Name: 2-(5-bromo-1,3-dioxo-2-isoindolyl)acetic acid [2-(4-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-nitrophenyl)-2-oxoethyl] 2-(5-bromo-1,3-dioxoisoindol-2-yl)acetate Traditional Name: 2-(5-bromo-1,3-diketo-isoindolin-2-yl)acetic acid [2-keto-2-(4-nitrophenyl)ethyl] ester Formula: C18H11BrN2O7 MolecularWeight: 447.19314

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)COC(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)COC(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C18H11BrN2O7/c19-11-3-6-13-14(7-11)18(25)20(17(13)24)8-16(23)28-9-15(22)10-1-4-12(5-2-10)21(26)27/h1-7H,8-9H2