methyl 4-[4-(5-chloranylpyridin-2-yl)-2-oxidanyl-phenoxy]pentanoate

Systemtic Name: methyl 4-[4-(5-chloranylpyridin-2-yl)-2-oxidanyl-phenoxy]pentanoate Openeye Name: methyl 4-[4-(5-chloro-2-pyridyl)-2-hydroxy-phenoxy]pentanoate CAS Name: 4-[4-(5-chloro-2-pyridinyl)-2-hydroxyphenoxy]pentanoic acid methyl ester IUPAC Name: methyl 4-[4-(5-chloropyridin-2-yl)-2-hydroxyphenoxy]pentanoate Traditional Name: 4-[4-(5-chloro-2-pyridyl)-2-hydroxy-phenoxy]valeric acid methyl ester Formula: C17H18ClNO4 MolecularWeight: 335.78212

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)OC)OC1=C(C=C(C=C1)C2=NC=C(C=C2)Cl)O

Isomeric SMILES

CC(CCC(=O)OC)OC1=C(C=C(C=C1)C2=NC=C(C=C2)Cl)O

InChI

InChI=1S/C17H18ClNO4/c1-11(3-8-17(21)22-2)23-16-7-4-12(9-15(16)20)14-6-5-13(18)10-19-14/h4-7,9-11,20H,3,8H2,1-2H3