methyl 2-(8-oxidanyl-1-pyridin-3-yl-octan-4-yl)oxyethanoate

Systemtic Name: methyl 2-(8-oxidanyl-1-pyridin-3-yl-octan-4-yl)oxyethanoate Openeye Name: methyl 2-[5-hydroxy-1-[3-(3-pyridyl)propyl]pentoxy]acetate CAS Name: 2-[8-hydroxy-1-(3-pyridinyl)octan-4-yl]oxyacetic acid methyl ester IUPAC Name: methyl 2-(8-hydroxy-1-pyridin-3-yloctan-4-yl)oxyacetate Traditional Name: 2-[5-hydroxy-1-[3-(3-pyridyl)propyl]pentoxy]acetic acid methyl ester Formula: C16H25NO4 MolecularWeight: 295.374

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC(CCCCO)CCCC1=CN=CC=C1

Isomeric SMILES

COC(=O)COC(CCCCO)CCCC1=CN=CC=C1

InChI

InChI=1S/C16H25NO4/c1-20-16(19)13-21-15(8-2-3-11-18)9-4-6-14-7-5-10-17-12-14/h5,7,10,12,15,18H,2-4,6,8-9,11,13H2,1H3