[2-methoxy-4-[(E)-[(2-pyrrol-1-ylphenyl)carbonylhydrazinylidene]methyl]phenyl] 2-bromanylbenzoate

Systemtic Name: [2-methoxy-4-[(E)-[(2-pyrrol-1-ylphenyl)carbonylhydrazinylidene]methyl]phenyl] 2-bromanylbenzoate Openeye Name: [2-methoxy-4-[(E)-[(2-pyrrol-1-ylbenzoyl)hydrazono]methyl]phenyl] 2-bromobenzoate CAS Name: 2-bromobenzoic acid [2-methoxy-4-[(E)-[[oxo-[2-(1-pyrrolyl)phenyl]methyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-[(2-pyrrol-1-ylbenzoyl)hydrazinylidene]methyl]phenyl] 2-bromobenzoate Traditional Name: 2-bromobenzoic acid [2-methoxy-4-[(E)-[(2-pyrrol-1-ylbenzoyl)hydrazono]methyl]phenyl] ester Formula: C26H20BrN3O4 MolecularWeight: 518.3587

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=O)C2=CC=CC=C2N3C=CC=C3)OC(=O)C4=CC=CC=C4Br

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC(=O)C2=CC=CC=C2N3C=CC=C3)OC(=O)C4=CC=CC=C4Br

InChI

InChI=1S/C26H20BrN3O4/c1-33-24-16-18(12-13-23(24)34-26(32)19-8-2-4-10-21(19)27)17-28-29-25(31)20-9-3-5-11-22(20)30-14-6-7-15-30/h2-17H,1H3,(H,29,31)/b28-17+