5-bromanyl-1-(2,2-dimethoxyethyl)-4-oxidanylidene-3-phenylmethoxy-pyridine-2-carboxylic acid

Systemtic Name: 5-bromanyl-1-(2,2-dimethoxyethyl)-4-oxidanylidene-3-phenylmethoxy-pyridine-2-carboxylic acid Openeye Name: 3-benzyloxy-5-bromo-1-(2,2-dimethoxyethyl)-4-oxo-pyridine-2-carboxylic acid CAS Name: 5-bromo-1-(2,2-dimethoxyethyl)-4-oxo-3-phenylmethoxy-2-pyridinecarboxylic acid IUPAC Name: 5-bromo-1-(2,2-dimethoxyethyl)-4-oxo-3-phenylmethoxypyridine-2-carboxylic acid Traditional Name: 3-benzoxy-5-bromo-1-(2,2-dimethoxyethyl)-4-keto-picolinic acid Formula: C17H18BrNO6 MolecularWeight: 412.23192

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Descriptors Computed from Structure

Canonical SMILES:

COC(CN1C=C(C(=O)C(=C1C(=O)O)OCC2=CC=CC=C2)Br)OC

Isomeric SMILES

COC(CN1C=C(C(=O)C(=C1C(=O)O)OCC2=CC=CC=C2)Br)OC

InChI

InChI=1S/C17H18BrNO6/c1-23-13(24-2)9-19-8-12(18)15(20)16(14(19)17(21)22)25-10-11-6-4-3-5-7-11/h3-8,13H,9-10H2,1-2H3,(H,21,22)