[4-(4-octoxyphenyl)phenyl] 3-chloranyl-4-(4-hexylcyclohexyl)benzoate

Systemtic Name: [4-(4-octoxyphenyl)phenyl] 3-chloranyl-4-(4-hexylcyclohexyl)benzoate Openeye Name: [4-(4-octoxyphenyl)phenyl] 3-chloro-4-(4-hexylcyclohexyl)benzoate CAS Name: 3-chloro-4-(4-hexylcyclohexyl)benzoic acid [4-(4-octoxyphenyl)phenyl] ester IUPAC Name: [4-(4-octoxyphenyl)phenyl] 3-chloro-4-(4-hexylcyclohexyl)benzoate Traditional Name: 3-chloro-4-(4-hexylcyclohexyl)benzoic acid [4-(4-octoxyphenyl)phenyl] ester Formula: C39H51ClO3 MolecularWeight: 603.27344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3)C4CCC(CC4)CCCCCC)Cl

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3)C4CCC(CC4)CCCCCC)Cl

InChI

InChI=1S/C39H51ClO3/c1-3-5-7-9-10-12-28-42-35-23-18-31(19-24-35)32-20-25-36(26-21-32)43-39(41)34-22-27-37(38(40)29-34)33-16-14-30(15-17-33)13-11-8-6-4-2/h18-27,29-30,33H,3-17,28H2,1-2H3