[2-bromanyl-4-[(E)-(phenylcarbonylhydrazinylidene)methyl]phenyl] 4-nitrobenzoate

Systemtic Name: [2-bromanyl-4-[(E)-(phenylcarbonylhydrazinylidene)methyl]phenyl] 4-nitrobenzoate Openeye Name: [4-[(E)-(benzoylhydrazono)methyl]-2-bromo-phenyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [4-[(E)-(benzoylhydrazinylidene)methyl]-2-bromophenyl] ester IUPAC Name: [4-[(E)-(benzoylhydrazinylidene)methyl]-2-bromophenyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [4-[(E)-(benzoylhydrazono)methyl]-2-bromo-phenyl] ester Formula: C21H14BrN3O5 MolecularWeight: 468.25696

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NN=CC2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

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

InChI

InChI=1S/C21H14BrN3O5/c22-18-12-14(13-23-24-20(26)15-4-2-1-3-5-15)6-11-19(18)30-21(27)16-7-9-17(10-8-16)25(28)29/h1-13H,(H,24,26)/b23-13+