[4-[4-(5-decylpyridin-2-yl)phenyl]phenyl] 8-cyclopentyloctanoate

Systemtic Name: [4-[4-(5-decylpyridin-2-yl)phenyl]phenyl] 8-cyclopentyloctanoate Openeye Name: [4-[4-(5-decyl-2-pyridyl)phenyl]phenyl] 8-cyclopentyloctanoate CAS Name: 8-cyclopentyloctanoic acid [4-[4-(5-decyl-2-pyridinyl)phenyl]phenyl] ester IUPAC Name: [4-[4-(5-decylpyridin-2-yl)phenyl]phenyl] 8-cyclopentyloctanoate Traditional Name: 8-cyclopentylcaprylic acid [4-[4-(5-decyl-2-pyridyl)phenyl]phenyl] ester Formula: C40H55NO2 MolecularWeight: 581.8702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)CCCCCCCC4CCCC4

Isomeric SMILES

CCCCCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)CCCCCCCC4CCCC4

InChI

InChI=1S/C40H55NO2/c1-2-3-4-5-6-7-9-13-20-34-22-31-39(41-32-34)37-25-23-35(24-26-37)36-27-29-38(30-28-36)43-40(42)21-14-11-8-10-12-17-33-18-15-16-19-33/h22-33H,2-21H2,1H3