4-[3-[2-(3-chloranylphenoxy)pyridin-3-yl]oxypropyl]-5-methoxy-pyridine-3-carboxylic acid

Systemtic Name: 4-[3-[2-(3-chloranylphenoxy)pyridin-3-yl]oxypropyl]-5-methoxy-pyridine-3-carboxylic acid Openeye Name: 4-[3-[[2-(3-chlorophenoxy)-3-pyridyl]oxy]propyl]-5-methoxy-pyridine-3-carboxylic acid CAS Name: 4-[3-[[2-(3-chlorophenoxy)-3-pyridinyl]oxy]propyl]-5-methoxy-3-pyridinecarboxylic acid IUPAC Name: 4-[3-[2-(3-chlorophenoxy)pyridin-3-yl]oxypropyl]-5-methoxypyridine-3-carboxylic acid Traditional Name: 4-[3-[[2-(3-chlorophenoxy)-3-pyridyl]oxy]propyl]-5-methoxy-nicotinic acid Formula: C21H19ClN2O5 MolecularWeight: 414.83896

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CN=C1)C(=O)O)CCCOC2=C(N=CC=C2)OC3=CC(=CC=C3)Cl

Isomeric SMILES

COC1=C(C(=CN=C1)C(=O)O)CCCOC2=C(N=CC=C2)OC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H19ClN2O5/c1-27-19-13-23-12-17(21(25)26)16(19)7-4-10-28-18-8-3-9-24-20(18)29-15-6-2-5-14(22)11-15/h2-3,5-6,8-9,11-13H,4,7,10H2,1H3,(H,25,26)