(5-acetyloxy-6-methyl-pyridin-3-yl)methyl octanoate

Systemtic Name: (5-acetyloxy-6-methyl-pyridin-3-yl)methyl octanoate Openeye Name: (5-acetoxy-6-methyl-3-pyridyl)methyl octanoate CAS Name: octanoic acid (5-acetyloxy-6-methyl-3-pyridinyl)methyl ester IUPAC Name: (5-acetyloxy-6-methylpyridin-3-yl)methyl octanoate Traditional Name: caprylic acid (5-acetoxy-6-methyl-3-pyridyl)methyl ester Formula: C17H25NO4 MolecularWeight: 307.3847

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OCC1=CC(=C(N=C1)C)OC(=O)C

Isomeric SMILES

CCCCCCCC(=O)OCC1=CC(=C(N=C1)C)OC(=O)C

InChI

InChI=1S/C17H25NO4/c1-4-5-6-7-8-9-17(20)21-12-15-10-16(22-14(3)19)13(2)18-11-15/h10-11H,4-9,12H2,1-3H3