[2-methoxy-4-[(Z)-(pyridin-3-ylcarbonylhydrazinylidene)methyl]phenyl] 3-bromanylbenzoate

Systemtic Name: [2-methoxy-4-[(Z)-(pyridin-3-ylcarbonylhydrazinylidene)methyl]phenyl] 3-bromanylbenzoate Openeye Name: [2-methoxy-4-[(Z)-(pyridine-3-carbonylhydrazono)methyl]phenyl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [2-methoxy-4-[(Z)-[[oxo(3-pyridinyl)methyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(Z)-(pyridine-3-carbonylhydrazinylidene)methyl]phenyl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [2-methoxy-4-[(Z)-(nicotinoylhydrazono)methyl]phenyl] ester Formula: C21H16BrN3O4 MolecularWeight: 454.27344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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