4-[(3-bromanyl-2-oxidanylidene-4-phenylmethoxy-pyridin-1-yl)methyl]benzoic acid

Systemtic Name: 4-[(3-bromanyl-2-oxidanylidene-4-phenylmethoxy-pyridin-1-yl)methyl]benzoic acid Openeye Name: 4-[(4-benzyloxy-3-bromo-2-oxo-1-pyridyl)methyl]benzoic acid CAS Name: 4-[(3-bromo-2-oxo-4-phenylmethoxy-1-pyridinyl)methyl]benzoic acid IUPAC Name: 4-[(3-bromo-2-oxo-4-phenylmethoxypyridin-1-yl)methyl]benzoic acid Traditional Name: 4-[(4-benzoxy-3-bromo-2-keto-1-pyridyl)methyl]benzoic acid Formula: C20H16BrNO4 MolecularWeight: 414.24934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16BrNO4/c21-18-17(26-13-15-4-2-1-3-5-15)10-11-22(19(18)23)12-14-6-8-16(9-7-14)20(24)25/h1-11H,12-13H2,(H,24,25)