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

Systemtic Name: [4-(4-octylphenyl)phenyl] 3-chloranyl-4-(4-octylphenyl)benzoate Openeye Name: [4-(4-octylphenyl)phenyl] 3-chloro-4-(4-octylphenyl)benzoate CAS Name: 3-chloro-4-(4-octylphenyl)benzoic acid [4-(4-octylphenyl)phenyl] ester IUPAC Name: [4-(4-octylphenyl)phenyl] 3-chloro-4-(4-octylphenyl)benzoate Traditional Name: 3-chloro-4-(4-octylphenyl)benzoic acid [4-(4-octylphenyl)phenyl] ester Formula: C41H49ClO2 MolecularWeight: 609.27956

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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)C4=CC=C(C=C4)CCCCCCCC)Cl

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3)C4=CC=C(C=C4)CCCCCCCC)Cl

InChI

InChI=1S/C41H49ClO2/c1-3-5-7-9-11-13-15-32-17-21-34(22-18-32)35-25-28-38(29-26-35)44-41(43)37-27-30-39(40(42)31-37)36-23-19-33(20-24-36)16-14-12-10-8-6-4-2/h17-31H,3-16H2,1-2H3