[3-[(E)-(pyridin-3-ylcarbonylhydrazinylidene)methyl]phenyl] 3-bromanylbenzoate

Systemtic Name: [3-[(E)-(pyridin-3-ylcarbonylhydrazinylidene)methyl]phenyl] 3-bromanylbenzoate Openeye Name: [3-[(E)-(pyridine-3-carbonylhydrazono)methyl]phenyl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [3-[(E)-[[oxo(3-pyridinyl)methyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [3-[(E)-(pyridine-3-carbonylhydrazinylidene)methyl]phenyl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [3-[(E)-(nicotinoylhydrazono)methyl]phenyl] ester Formula: C20H14BrN3O3 MolecularWeight: 424.24746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC(=O)C2=CC(=CC=C2)Br)C=NNC(=O)C3=CN=CC=C3

Isomeric SMILES

C1=CC(=CC(=C1)OC(=O)C2=CC(=CC=C2)Br)/C=N/NC(=O)C3=CN=CC=C3

InChI

InChI=1S/C20H14BrN3O3/c21-17-7-2-5-15(11-17)20(26)27-18-8-1-4-14(10-18)12-23-24-19(25)16-6-3-9-22-13-16/h1-13H,(H,24,25)/b23-12+