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5-[4-(4-decoxyphenyl)phenyl]-2-octan-2-yloxy-benzenecarbonitrile

5-[4-(4-decoxyphenyl)phenyl]-2-octan-2-yloxy-benzenecarbonitrile

Systemtic Name:5-[4-(4-decoxyphenyl)phenyl]-2-octan-2-yloxy-benzenecarbonitrile
Openeye Name:5-[4-(4-decoxyphenyl)phenyl]-2-(1-methylheptoxy)benzonitrile
CAS Name:5-[4-(4-decoxyphenyl)phenyl]-2-octan-2-yloxybenzonitrile
IUPAC Name:5-[4-(4-decoxyphenyl)phenyl]-2-octan-2-yloxybenzonitrile
Traditional Name:5-[4-(4-decoxyphenyl)phenyl]-2-(1-methylheptoxy)benzonitrile
Formula: C37H49NO2
MolecularWeight: 539.79046
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC(=C(C=C3)OC(C)CCCCCC)C#N


Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC(=C(C=C3)OC(C)CCCCCC)C#N


InChI

InChI=1S/C37H49NO2/c1-4-6-8-10-11-12-13-15-27-39-36-24-21-32(22-25-36)31-17-19-33(20-18-31)34-23-26-37(35(28-34)29-38)40-30(3)16-14-9-7-5-2/h17-26,28,30H,4-16,27H2,1-3H3


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