[(E)-2-(5-bromanyl-2-phenylmethoxy-phenyl)ethenyl] 4-oxidanylidene-1H-pyridine-3-carboxylate

Systemtic Name: [(E)-2-(5-bromanyl-2-phenylmethoxy-phenyl)ethenyl] 4-oxidanylidene-1H-pyridine-3-carboxylate Openeye Name: [(E)-2-(2-benzyloxy-5-bromo-phenyl)vinyl] 4-oxo-1H-pyridine-3-carboxylate CAS Name: 4-oxo-1H-pyridine-3-carboxylic acid [(E)-2-(5-bromo-2-phenylmethoxyphenyl)ethenyl] ester IUPAC Name: [(E)-2-(5-bromo-2-phenylmethoxyphenyl)ethenyl] 4-oxo-1H-pyridine-3-carboxylate Traditional Name: 4-keto-1H-pyridine-3-carboxylic acid [(E)-2-(2-benzoxy-5-bromo-phenyl)vinyl] ester Formula: C21H16BrNO4 MolecularWeight: 426.26004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)C=COC(=O)C3=CNC=CC3=O

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)/C=C/OC(=O)C3=CNC=CC3=O

InChI

InChI=1S/C21H16BrNO4/c22-17-6-7-20(27-14-15-4-2-1-3-5-15)16(12-17)9-11-26-21(25)18-13-23-10-8-19(18)24/h1-13H,14H2,(H,23,24)/b11-9+