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

Systemtic Name: [4-(4-octoxyphenyl)phenyl] 3-chloranyl-4-(4-octylcyclohexyl)benzoate Openeye Name: [4-(4-octoxyphenyl)phenyl] 3-chloro-4-(4-octylcyclohexyl)benzoate CAS Name: 3-chloro-4-(4-octylcyclohexyl)benzoic acid [4-(4-octoxyphenyl)phenyl] ester IUPAC Name: [4-(4-octoxyphenyl)phenyl] 3-chloro-4-(4-octylcyclohexyl)benzoate Traditional Name: 3-chloro-4-(4-octylcyclohexyl)benzoic acid [4-(4-octoxyphenyl)phenyl] ester Formula: C41H55ClO3 MolecularWeight: 631.3266

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(CC1)C2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)OCCCCCCCC)Cl

Isomeric SMILES

CCCCCCCCC1CCC(CC1)C2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)OCCCCCCCC)Cl

InChI

InChI=1S/C41H55ClO3/c1-3-5-7-9-11-13-15-32-16-18-35(19-17-32)39-29-24-36(31-40(39)42)41(43)45-38-27-22-34(23-28-38)33-20-25-37(26-21-33)44-30-14-12-10-8-6-4-2/h20-29,31-32,35H,3-19,30H2,1-2H3