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2-[[4-[4-(5-octylpyrimidin-2-yl)phenyl]phenyl]methyl]pentanenitrile

2-[[4-[4-(5-octylpyrimidin-2-yl)phenyl]phenyl]methyl]pentanenitrile

Systemtic Name:2-[[4-[4-(5-octylpyrimidin-2-yl)phenyl]phenyl]methyl]pentanenitrile
Openeye Name:2-[[4-[4-(5-octylpyrimidin-2-yl)phenyl]phenyl]methyl]pentanenitrile
CAS Name:2-[[4-[4-(5-octyl-2-pyrimidinyl)phenyl]phenyl]methyl]pentanenitrile
IUPAC Name:2-[[4-[4-(5-octylpyrimidin-2-yl)phenyl]phenyl]methyl]pentanenitrile
Traditional Name:2-[4-[4-(5-octylpyrimidin-2-yl)phenyl]benzyl]valeronitrile
Formula: C30H37N3
MolecularWeight: 439.63488
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)CC(CCC)C#N


Isomeric SMILES

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)CC(CCC)C#N


InChI

InChI=1S/C30H37N3/c1-3-5-6-7-8-9-11-26-22-32-30(33-23-26)29-18-16-28(17-19-29)27-14-12-24(13-15-27)20-25(21-31)10-4-2/h12-19,22-23,25H,3-11,20H2,1-2H3


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