[3-[(E)-[2-(4-bromanyl-2-cyano-phenoxy)ethanoylhydrazinylidene]methyl]phenyl] 4-nitrobenzoate

Systemtic Name: [3-[(E)-[2-(4-bromanyl-2-cyano-phenoxy)ethanoylhydrazinylidene]methyl]phenyl] 4-nitrobenzoate Openeye Name: [3-[(E)-[[2-(4-bromo-2-cyano-phenoxy)acetyl]hydrazono]methyl]phenyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [3-[(E)-[[2-(4-bromo-2-cyanophenoxy)-1-oxoethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [3-[(E)-[[2-(4-bromo-2-cyanophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [3-[(E)-[[2-(4-bromo-2-cyano-phenoxy)acetyl]hydrazono]methyl]phenyl] ester Formula: C23H15BrN4O6 MolecularWeight: 523.2924

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C=NNC(=O)COC3=C(C=C(C=C3)Br)C#N

Isomeric SMILES

C1=CC(=CC(=C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])/C=N/NC(=O)COC3=C(C=C(C=C3)Br)C#N

InChI

InChI=1S/C23H15BrN4O6/c24-18-6-9-21(17(11-18)12-25)33-14-22(29)27-26-13-15-2-1-3-20(10-15)34-23(30)16-4-7-19(8-5-16)28(31)32/h1-11,13H,14H2,(H,27,29)/b26-13+