9-[1-[4-[4-(5-pentylpyrimidin-2-yl)phenyl]phenyl]cyclopentyl]nonanoate

Systemtic Name: 9-[1-[4-[4-(5-pentylpyrimidin-2-yl)phenyl]phenyl]cyclopentyl]nonanoate Openeye Name: 9-[1-[4-[4-(5-pentylpyrimidin-2-yl)phenyl]phenyl]cyclopentyl]nonanoate CAS Name: 9-[1-[4-[4-(5-pentyl-2-pyrimidinyl)phenyl]phenyl]cyclopentyl]nonanoate IUPAC Name: 9-[1-[4-[4-(5-pentylpyrimidin-2-yl)phenyl]phenyl]cyclopentyl]nonanoate Traditional Name: 9-[1-[4-[4-(5-amylpyrimidin-2-yl)phenyl]phenyl]cyclopentyl]pelargonate Formula: C35H45N2O2- MolecularWeight: 525.744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4(CCCC4)CCCCCCCCC(=O)[O-]

Isomeric SMILES

CCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4(CCCC4)CCCCCCCCC(=O)[O-]

InChI

InChI=1S/C35H46N2O2/c1-2-3-8-13-28-26-36-34(37-27-28)31-17-15-29(16-18-31)30-19-21-32(22-20-30)35(24-11-12-25-35)23-10-7-5-4-6-9-14-33(38)39/h15-22,26-27H,2-14,23-25H2,1H3,(H,38,39)/p-1