[3-[(E)-[(2-pyrrol-1-ylphenyl)carbonylhydrazinylidene]methyl]phenyl] 2-bromanylbenzoate

Systemtic Name: [3-[(E)-[(2-pyrrol-1-ylphenyl)carbonylhydrazinylidene]methyl]phenyl] 2-bromanylbenzoate Openeye Name: [3-[(E)-[(2-pyrrol-1-ylbenzoyl)hydrazono]methyl]phenyl] 2-bromobenzoate CAS Name: 2-bromobenzoic acid [3-[(E)-[[oxo-[2-(1-pyrrolyl)phenyl]methyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [3-[(E)-[(2-pyrrol-1-ylbenzoyl)hydrazinylidene]methyl]phenyl] 2-bromobenzoate Traditional Name: 2-bromobenzoic acid [3-[(E)-[(2-pyrrol-1-ylbenzoyl)hydrazono]methyl]phenyl] ester Formula: C25H18BrN3O3 MolecularWeight: 488.33272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NN=CC2=CC(=CC=C2)OC(=O)C3=CC=CC=C3Br)N4C=CC=C4

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)N/N=C/C2=CC(=CC=C2)OC(=O)C3=CC=CC=C3Br)N4C=CC=C4

InChI

InChI=1S/C25H18BrN3O3/c26-22-12-3-1-10-20(22)25(31)32-19-9-7-8-18(16-19)17-27-28-24(30)21-11-2-4-13-23(21)29-14-5-6-15-29/h1-17H,(H,28,30)/b27-17+