methyl 3-[3-(3-pyridin-4-ylpropoxy)pyridin-2-yl]oxybenzoate

Systemtic Name: methyl 3-[3-(3-pyridin-4-ylpropoxy)pyridin-2-yl]oxybenzoate Openeye Name: methyl 3-[[3-[3-(4-pyridyl)propoxy]-2-pyridyl]oxy]benzoate CAS Name: 3-[[3-(3-pyridin-4-ylpropoxy)-2-pyridinyl]oxy]benzoic acid methyl ester IUPAC Name: methyl 3-[3-(3-pyridin-4-ylpropoxy)pyridin-2-yl]oxybenzoate Traditional Name: 3-[[3-[3-(4-pyridyl)propoxy]-2-pyridyl]oxy]benzoic acid methyl ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2O4/c1-25-21(24)17-6-2-7-18(15-17)27-20-19(8-3-11-23-20)26-14-4-5-16-9-12-22-13-10-16/h2-3,6-13,15H,4-5,14H2,1H3