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[2-cyano-4-(2-methylpropyl)phenyl] 4-(4-hexylcyclohexyl)benzoate

[2-cyano-4-(2-methylpropyl)phenyl] 4-(4-hexylcyclohexyl)benzoate

Systemtic Name:[2-cyano-4-(2-methylpropyl)phenyl] 4-(4-hexylcyclohexyl)benzoate
Openeye Name:(2-cyano-4-isobutyl-phenyl) 4-(4-hexylcyclohexyl)benzoate
CAS Name:4-(4-hexylcyclohexyl)benzoic acid [2-cyano-4-(2-methylpropyl)phenyl] ester
IUPAC Name:[2-cyano-4-(2-methylpropyl)phenyl] 4-(4-hexylcyclohexyl)benzoate
Traditional Name:4-(4-hexylcyclohexyl)benzoic acid (2-cyano-4-isobutyl-phenyl) ester
Formula: C30H39NO2
MolecularWeight: 445.63616
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)CC(C)C)C#N


Isomeric SMILES

CCCCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)CC(C)C)C#N


InChI

InChI=1S/C30H39NO2/c1-4-5-6-7-8-23-9-12-25(13-10-23)26-14-16-27(17-15-26)30(32)33-29-18-11-24(19-22(2)3)20-28(29)21-31/h11,14-18,20,22-23,25H,4-10,12-13,19H2,1-3H3


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