[4-[4-(5-hexoxypyridin-2-yl)phenoxy]phenyl] hexanoate

Systemtic Name: [4-[4-(5-hexoxypyridin-2-yl)phenoxy]phenyl] hexanoate Openeye Name: [4-[4-(5-hexoxy-2-pyridyl)phenoxy]phenyl] hexanoate CAS Name: hexanoic acid [4-[4-(5-hexoxy-2-pyridinyl)phenoxy]phenyl] ester IUPAC Name: [4-[4-(5-hexoxypyridin-2-yl)phenoxy]phenyl] hexanoate Traditional Name: hexanoic acid [4-[4-(5-hexoxy-2-pyridyl)phenoxy]phenyl] ester Formula: C29H35NO4 MolecularWeight: 461.5925

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CN=C(C=C1)C2=CC=C(C=C2)OC3=CC=C(C=C3)OC(=O)CCCCC

Isomeric SMILES

CCCCCCOC1=CN=C(C=C1)C2=CC=C(C=C2)OC3=CC=C(C=C3)OC(=O)CCCCC

InChI

InChI=1S/C29H35NO4/c1-3-5-7-9-21-32-27-19-20-28(30-22-27)23-11-13-24(14-12-23)33-25-15-17-26(18-16-25)34-29(31)10-8-6-4-2/h11-20,22H,3-10,21H2,1-2H3