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[4-(4-octylcyclohexyl)cyclohexyl] 3-cyano-4-pentoxy-benzoate

[4-(4-octylcyclohexyl)cyclohexyl] 3-cyano-4-pentoxy-benzoate

Systemtic Name:[4-(4-octylcyclohexyl)cyclohexyl] 3-cyano-4-pentoxy-benzoate
Openeye Name:[4-(4-octylcyclohexyl)cyclohexyl] 3-cyano-4-pentoxy-benzoate
CAS Name:3-cyano-4-pentoxybenzoic acid [4-(4-octylcyclohexyl)cyclohexyl] ester
IUPAC Name:[4-(4-octylcyclohexyl)cyclohexyl] 3-cyano-4-pentoxybenzoate
Traditional Name:4-amoxy-3-cyano-benzoic acid [4-(4-octylcyclohexyl)cyclohexyl] ester
Formula: C33H51NO3
MolecularWeight: 509.76294
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(CC1)C2CCC(CC2)OC(=O)C3=CC(=C(C=C3)OCCCCC)C#N


Isomeric SMILES

CCCCCCCCC1CCC(CC1)C2CCC(CC2)OC(=O)C3=CC(=C(C=C3)OCCCCC)C#N


InChI

InChI=1S/C33H51NO3/c1-3-5-7-8-9-10-12-26-13-15-27(16-14-26)28-17-20-31(21-18-28)37-33(35)29-19-22-32(30(24-29)25-34)36-23-11-6-4-2/h19,22,24,26-28,31H,3-18,20-21,23H2,1-2H3


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