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

Systemtic Name: [2-[3-(2-methylbutoxy)pyridin-4-yl]phenyl] undecanoate Openeye Name: [2-[3-(2-methylbutoxy)-4-pyridyl]phenyl] undecanoate CAS Name: undecanoic acid [2-[3-(2-methylbutoxy)-4-pyridinyl]phenyl] ester IUPAC Name: [2-[3-(2-methylbutoxy)pyridin-4-yl]phenyl] undecanoate Traditional Name: undecanoic acid [2-[3-(2-methylbutoxy)-4-pyridyl]phenyl] ester Formula: C27H39NO3 MolecularWeight: 425.60346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H39NO3/c1-4-6-7-8-9-10-11-12-17-27(29)31-25-16-14-13-15-23(25)24-18-19-28-20-26(24)30-21-22(3)5-2/h13-16,18-20,22H,4-12,17,21H2,1-3H3