ethyl 3-[3-[3-(3-oxidanylpyridin-4-yl)propoxy]pyridin-2-yl]oxybenzoate

Systemtic Name: ethyl 3-[3-[3-(3-oxidanylpyridin-4-yl)propoxy]pyridin-2-yl]oxybenzoate Openeye Name: ethyl 3-[[3-[3-(3-hydroxy-4-pyridyl)propoxy]-2-pyridyl]oxy]benzoate CAS Name: 3-[[3-[3-(3-hydroxy-4-pyridinyl)propoxy]-2-pyridinyl]oxy]benzoic acid ethyl ester IUPAC Name: ethyl 3-[3-[3-(3-hydroxypyridin-4-yl)propoxy]pyridin-2-yl]oxybenzoate Traditional Name: 3-[[3-[3-(3-hydroxy-4-pyridyl)propoxy]-2-pyridyl]oxy]benzoic acid ethyl ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)OC2=C(C=CC=N2)OCCCC3=C(C=NC=C3)O

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)OC2=C(C=CC=N2)OCCCC3=C(C=NC=C3)O

InChI

InChI=1S/C22H22N2O5/c1-2-27-22(26)17-6-3-8-18(14-17)29-21-20(9-4-11-24-21)28-13-5-7-16-10-12-23-15-19(16)25/h3-4,6,8-12,14-15,25H,2,5,7,13H2,1H3