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

Systemtic Name: 1-(2,2-dimethoxyethyl)-5-(2-methylpropylamino)-4-oxidanylidene-3-phenylmethoxy-pyridine-2-carboxylic acid Openeye Name: 3-benzyloxy-1-(2,2-dimethoxyethyl)-5-(isobutylamino)-4-oxo-pyridine-2-carboxylic acid CAS Name: 1-(2,2-dimethoxyethyl)-5-(2-methylpropylamino)-4-oxo-3-phenylmethoxy-2-pyridinecarboxylic acid IUPAC Name: 1-(2,2-dimethoxyethyl)-5-(2-methylpropylamino)-4-oxo-3-phenylmethoxypyridine-2-carboxylic acid Traditional Name: 3-benzoxy-1-(2,2-dimethoxyethyl)-5-(isobutylamino)-4-keto-picolinic acid Formula: C21H28N2O6 MolecularWeight: 404.45682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=CN(C(=C(C1=O)OCC2=CC=CC=C2)C(=O)O)CC(OC)OC

Isomeric SMILES

CC(C)CNC1=CN(C(=C(C1=O)OCC2=CC=CC=C2)C(=O)O)CC(OC)OC

InChI

InChI=1S/C21H28N2O6/c1-14(2)10-22-16-11-23(12-17(27-3)28-4)18(21(25)26)20(19(16)24)29-13-15-8-6-5-7-9-15/h5-9,11,14,17,22H,10,12-13H2,1-4H3,(H,25,26)