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(4-butyl-4-cyano-cyclohexyl) 4-(4-octoxyphenyl)benzoate

(4-butyl-4-cyano-cyclohexyl) 4-(4-octoxyphenyl)benzoate

Systemtic Name:(4-butyl-4-cyano-cyclohexyl) 4-(4-octoxyphenyl)benzoate
Openeye Name:(4-butyl-4-cyano-cyclohexyl) 4-(4-octoxyphenyl)benzoate
CAS Name:4-(4-octoxyphenyl)benzoic acid (4-butyl-4-cyanocyclohexyl) ester
IUPAC Name:(4-butyl-4-cyanocyclohexyl) 4-(4-octoxyphenyl)benzoate
Traditional Name:4-(4-octoxyphenyl)benzoic acid (4-butyl-4-cyano-cyclohexyl) ester
Formula: C32H43NO3
MolecularWeight: 489.68872
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3CCC(CC3)(CCCC)C#N


Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3CCC(CC3)(CCCC)C#N


InChI

InChI=1S/C32H43NO3/c1-3-5-7-8-9-10-24-35-29-17-15-27(16-18-29)26-11-13-28(14-12-26)31(34)36-30-19-22-32(25-33,23-20-30)21-6-4-2/h11-18,30H,3-10,19-24H2,1-2H3


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