[4-bromanyl-2-[(E)-(pyridin-3-ylcarbonylhydrazinylidene)methyl]phenyl] 4-methoxybenzoate

Systemtic Name: [4-bromanyl-2-[(E)-(pyridin-3-ylcarbonylhydrazinylidene)methyl]phenyl] 4-methoxybenzoate Openeye Name: [4-bromo-2-[(E)-(pyridine-3-carbonylhydrazono)methyl]phenyl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [4-bromo-2-[(E)-[[oxo(3-pyridinyl)methyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-(pyridine-3-carbonylhydrazinylidene)methyl]phenyl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [4-bromo-2-[(E)-(nicotinoylhydrazono)methyl]phenyl] ester Formula: C21H16BrN3O4 MolecularWeight: 454.27344

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)Br)C=NNC(=O)C3=CN=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)Br)/C=N/NC(=O)C3=CN=CC=C3

InChI

InChI=1S/C21H16BrN3O4/c1-28-18-7-4-14(5-8-18)21(27)29-19-9-6-17(22)11-16(19)13-24-25-20(26)15-3-2-10-23-12-15/h2-13H,1H3,(H,25,26)/b24-13+