[4-(4-octylphenyl)phenyl] 3-chloranyl-4-(4-pentylcyclohexyl)benzoate

Systemtic Name: [4-(4-octylphenyl)phenyl] 3-chloranyl-4-(4-pentylcyclohexyl)benzoate Openeye Name: [4-(4-octylphenyl)phenyl] 3-chloro-4-(4-pentylcyclohexyl)benzoate CAS Name: 3-chloro-4-(4-pentylcyclohexyl)benzoic acid [4-(4-octylphenyl)phenyl] ester IUPAC Name: [4-(4-octylphenyl)phenyl] 3-chloro-4-(4-pentylcyclohexyl)benzoate Traditional Name: 4-(4-amylcyclohexyl)-3-chloro-benzoic acid [4-(4-octylphenyl)phenyl] ester Formula: C38H49ClO2 MolecularWeight: 573.24746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3)C4CCC(CC4)CCCCC)Cl

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3)C4CCC(CC4)CCCCC)Cl

InChI

InChI=1S/C38H49ClO2/c1-3-5-7-8-9-11-13-30-14-18-31(19-15-30)32-22-25-35(26-23-32)41-38(40)34-24-27-36(37(39)28-34)33-20-16-29(17-21-33)12-10-6-4-2/h14-15,18-19,22-29,33H,3-13,16-17,20-21H2,1-2H3