8-[1-[4-[4-(5-octylpyridin-2-yl)phenyl]phenyl]cyclopentyl]octanoate

Systemtic Name: 8-[1-[4-[4-(5-octylpyridin-2-yl)phenyl]phenyl]cyclopentyl]octanoate Openeye Name: 8-[1-[4-[4-(5-octyl-2-pyridyl)phenyl]phenyl]cyclopentyl]octanoate CAS Name: 8-[1-[4-[4-(5-octyl-2-pyridinyl)phenyl]phenyl]cyclopentyl]octanoate IUPAC Name: 8-[1-[4-[4-(5-octylpyridin-2-yl)phenyl]phenyl]cyclopentyl]octanoate Traditional Name: 8-[1-[4-[4-(5-octyl-2-pyridyl)phenyl]phenyl]cyclopentyl]caprylate Formula: C38H50NO2- MolecularWeight: 552.8091

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4(CCCC4)CCCCCCCC(=O)[O-]

Isomeric SMILES

CCCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4(CCCC4)CCCCCCCC(=O)[O-]

InChI

InChI=1S/C38H51NO2/c1-2-3-4-5-7-10-15-31-17-26-36(39-30-31)34-20-18-32(19-21-34)33-22-24-35(25-23-33)38(28-13-14-29-38)27-12-9-6-8-11-16-37(40)41/h17-26,30H,2-16,27-29H2,1H3,(H,40,41)/p-1