[4-[5-(2-methylbutoxy)pyridin-2-yl]phenyl] octanoate

Systemtic Name: [4-[5-(2-methylbutoxy)pyridin-2-yl]phenyl] octanoate Openeye Name: [4-[5-(2-methylbutoxy)-2-pyridyl]phenyl] octanoate CAS Name: octanoic acid [4-[5-(2-methylbutoxy)-2-pyridinyl]phenyl] ester IUPAC Name: [4-[5-(2-methylbutoxy)pyridin-2-yl]phenyl] octanoate Traditional Name: caprylic acid [4-[5-(2-methylbutoxy)-2-pyridyl]phenyl] ester Formula: C24H33NO3 MolecularWeight: 383.52372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC1=CC=C(C=C1)C2=NC=C(C=C2)OCC(C)CC

Isomeric SMILES

CCCCCCCC(=O)OC1=CC=C(C=C1)C2=NC=C(C=C2)OCC(C)CC

InChI

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