[2-[3-(2-methylbutoxy)pyridin-4-yl]phenyl] octanoate

Systemtic Name: [2-[3-(2-methylbutoxy)pyridin-4-yl]phenyl] octanoate Openeye Name: [2-[3-(2-methylbutoxy)-4-pyridyl]phenyl] octanoate CAS Name: octanoic acid [2-[3-(2-methylbutoxy)-4-pyridinyl]phenyl] ester IUPAC Name: [2-[3-(2-methylbutoxy)pyridin-4-yl]phenyl] octanoate Traditional Name: caprylic acid [2-[3-(2-methylbutoxy)-4-pyridyl]phenyl] ester Formula: C24H33NO3 MolecularWeight: 383.52372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC1=CC=CC=C1C2=C(C=NC=C2)OCC(C)CC

Isomeric SMILES

CCCCCCCC(=O)OC1=CC=CC=C1C2=C(C=NC=C2)OCC(C)CC

InChI

InChI=1S/C24H33NO3/c1-4-6-7-8-9-14-24(26)28-22-13-11-10-12-20(22)21-15-16-25-17-23(21)27-18-19(3)5-2/h10-13,15-17,19H,4-9,14,18H2,1-3H3