(4-chloranyl-2-cyano-phenyl) 4-[4-(4-propylcyclohexyl)cyclohexyl]benzoate

Systemtic Name: (4-chloranyl-2-cyano-phenyl) 4-[4-(4-propylcyclohexyl)cyclohexyl]benzoate Openeye Name: (4-chloro-2-cyano-phenyl) 4-[4-(4-propylcyclohexyl)cyclohexyl]benzoate CAS Name: 4-[4-(4-propylcyclohexyl)cyclohexyl]benzoic acid (4-chloro-2-cyanophenyl) ester IUPAC Name: (4-chloro-2-cyanophenyl) 4-[4-(4-propylcyclohexyl)cyclohexyl]benzoate Traditional Name: 4-[4-(4-propylcyclohexyl)cyclohexyl]benzoic acid (4-chloro-2-cyano-phenyl) ester Formula: C29H34ClNO2 MolecularWeight: 464.03876

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(CC1)C2CCC(CC2)C3=CC=C(C=C3)C(=O)OC4=C(C=C(C=C4)Cl)C#N

Isomeric SMILES

CCCC1CCC(CC1)C2CCC(CC2)C3=CC=C(C=C3)C(=O)OC4=C(C=C(C=C4)Cl)C#N

InChI

InChI=1S/C29H34ClNO2/c1-2-3-20-4-6-21(7-5-20)22-8-10-23(11-9-22)24-12-14-25(15-13-24)29(32)33-28-17-16-27(30)18-26(28)19-31/h12-18,20-23H,2-11H2,1H3