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[4-(4-hexylcyclohexyl)cyclohexyl] 3-cyano-4-nonoxy-benzoate

[4-(4-hexylcyclohexyl)cyclohexyl] 3-cyano-4-nonoxy-benzoate

Systemtic Name:[4-(4-hexylcyclohexyl)cyclohexyl] 3-cyano-4-nonoxy-benzoate
Openeye Name:[4-(4-hexylcyclohexyl)cyclohexyl] 3-cyano-4-nonoxy-benzoate
CAS Name:3-cyano-4-nonoxybenzoic acid [4-(4-hexylcyclohexyl)cyclohexyl] ester
IUPAC Name:[4-(4-hexylcyclohexyl)cyclohexyl] 3-cyano-4-nonoxybenzoate
Traditional Name:3-cyano-4-nonoxy-benzoic acid [4-(4-hexylcyclohexyl)cyclohexyl] ester
Formula: C35H55NO3
MolecularWeight: 537.8161
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=C(C=C(C=C1)C(=O)OC2CCC(CC2)C3CCC(CC3)CCCCCC)C#N


Isomeric SMILES

CCCCCCCCCOC1=C(C=C(C=C1)C(=O)OC2CCC(CC2)C3CCC(CC3)CCCCCC)C#N


InChI

InChI=1S/C35H55NO3/c1-3-5-7-9-10-11-13-25-38-34-24-21-31(26-32(34)27-36)35(37)39-33-22-19-30(20-23-33)29-17-15-28(16-18-29)14-12-8-6-4-2/h21,24,26,28-30,33H,3-20,22-23,25H2,1-2H3


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