[4-(5-butoxypyridin-2-yl)phenyl] 6-methyloctanoate

Systemtic Name: [4-(5-butoxypyridin-2-yl)phenyl] 6-methyloctanoate Openeye Name: [4-(5-butoxy-2-pyridyl)phenyl] 6-methyloctanoate CAS Name: 6-methyloctanoic acid [4-(5-butoxy-2-pyridinyl)phenyl] ester IUPAC Name: [4-(5-butoxypyridin-2-yl)phenyl] 6-methyloctanoate Traditional Name: 6-methylcaprylic acid [4-(5-butoxy-2-pyridyl)phenyl] ester Formula: C24H33NO3 MolecularWeight: 383.52372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CN=C(C=C1)C2=CC=C(C=C2)OC(=O)CCCCC(C)CC

Isomeric SMILES

CCCCOC1=CN=C(C=C1)C2=CC=C(C=C2)OC(=O)CCCCC(C)CC

InChI

InChI=1S/C24H33NO3/c1-4-6-17-27-22-15-16-23(25-18-22)20-11-13-21(14-12-20)28-24(26)10-8-7-9-19(3)5-2/h11-16,18-19H,4-10,17H2,1-3H3