methyl 4-[4-[oxidanyl(pyridin-3-yl)methyl]phenyl]butanoate

Systemtic Name: methyl 4-[4-[oxidanyl(pyridin-3-yl)methyl]phenyl]butanoate Openeye Name: methyl 4-[4-[hydroxy(3-pyridyl)methyl]phenyl]butanoate CAS Name: 4-[4-[hydroxy(3-pyridinyl)methyl]phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-[hydroxy(pyridin-3-yl)methyl]phenyl]butanoate Traditional Name: 4-[4-[hydroxy(3-pyridyl)methyl]phenyl]butyric acid methyl ester Formula: C17H19NO3 MolecularWeight: 285.33766

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC1=CC=C(C=C1)C(C2=CN=CC=C2)O

Isomeric SMILES

COC(=O)CCCC1=CC=C(C=C1)C(C2=CN=CC=C2)O

InChI

InChI=1S/C17H19NO3/c1-21-16(19)6-2-4-13-7-9-14(10-8-13)17(20)15-5-3-11-18-12-15/h3,5,7-12,17,20H,2,4,6H2,1H3