methyl 4-[3-(3-oxidanylpyridin-2-yl)propyl]benzoate

Systemtic Name: methyl 4-[3-(3-oxidanylpyridin-2-yl)propyl]benzoate Openeye Name: methyl 4-[3-(3-hydroxy-2-pyridyl)propyl]benzoate CAS Name: 4-[3-(3-hydroxy-2-pyridinyl)propyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(3-hydroxypyridin-2-yl)propyl]benzoate Traditional Name: 4-[3-(3-hydroxy-2-pyridyl)propyl]benzoic acid methyl ester Formula: C16H17NO3 MolecularWeight: 271.31108

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CCCC2=C(C=CC=N2)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CCCC2=C(C=CC=N2)O

InChI

InChI=1S/C16H17NO3/c1-20-16(19)13-9-7-12(8-10-13)4-2-5-14-15(18)6-3-11-17-14/h3,6-11,18H,2,4-5H2,1H3