6-[1-[4-[4-(5-hexylpyrimidin-2-yl)phenyl]phenyl]cyclopentyl]hexanoate

Systemtic Name: 6-[1-[4-[4-(5-hexylpyrimidin-2-yl)phenyl]phenyl]cyclopentyl]hexanoate Openeye Name: 6-[1-[4-[4-(5-hexylpyrimidin-2-yl)phenyl]phenyl]cyclopentyl]hexanoate CAS Name: 6-[1-[4-[4-(5-hexyl-2-pyrimidinyl)phenyl]phenyl]cyclopentyl]hexanoate IUPAC Name: 6-[1-[4-[4-(5-hexylpyrimidin-2-yl)phenyl]phenyl]cyclopentyl]hexanoate Traditional Name: 6-[1-[4-[4-(5-hexylpyrimidin-2-yl)phenyl]phenyl]cyclopentyl]hexanoate Formula: C33H41N2O2- MolecularWeight: 497.69084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4(CCCC4)CCCCCC(=O)[O-]

Isomeric SMILES

CCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4(CCCC4)CCCCCC(=O)[O-]

InChI

InChI=1S/C33H42N2O2/c1-2-3-4-6-11-26-24-34-32(35-25-26)29-15-13-27(14-16-29)28-17-19-30(20-18-28)33(22-9-10-23-33)21-8-5-7-12-31(36)37/h13-20,24-25H,2-12,21-23H2,1H3,(H,36,37)/p-1