phenacyl 2-(2-bromanyl-4-nitro-phenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: phenacyl 2-(2-bromanyl-4-nitro-phenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: phenacyl 2-(2-bromo-4-nitro-phenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(2-bromo-4-nitrophenyl)-1,3-dioxo-5-isoindolecarboxylic acid phenacyl ester IUPAC Name: phenacyl 2-(2-bromo-4-nitrophenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(2-bromo-4-nitro-phenyl)-1,3-diketo-isoindoline-5-carboxylic acid phenacyl ester Formula: C23H13BrN2O7 MolecularWeight: 509.26252

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=C(C=C(C=C4)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=C(C=C(C=C4)[N+](=O)[O-])Br

InChI

InChI=1S/C23H13BrN2O7/c24-18-11-15(26(31)32)7-9-19(18)25-21(28)16-8-6-14(10-17(16)22(25)29)23(30)33-12-20(27)13-4-2-1-3-5-13/h1-11H,12H2