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

Systemtic Name: [4-(4-nonoxyphenyl)phenyl] 3-chloranyl-4-(4-octylcyclohexyl)benzoate Openeye Name: [4-(4-nonoxyphenyl)phenyl] 3-chloro-4-(4-octylcyclohexyl)benzoate CAS Name: 3-chloro-4-(4-octylcyclohexyl)benzoic acid [4-(4-nonoxyphenyl)phenyl] ester IUPAC Name: [4-(4-nonoxyphenyl)phenyl] 3-chloro-4-(4-octylcyclohexyl)benzoate Traditional Name: 3-chloro-4-(4-octylcyclohexyl)benzoic acid [4-(4-nonoxyphenyl)phenyl] ester Formula: C42H57ClO3 MolecularWeight: 645.35318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3)C4CCC(CC4)CCCCCCCC)Cl

Isomeric SMILES

CCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3)C4CCC(CC4)CCCCCCCC)Cl

InChI

InChI=1S/C42H57ClO3/c1-3-5-7-9-11-13-15-31-45-38-26-21-34(22-27-38)35-23-28-39(29-24-35)46-42(44)37-25-30-40(41(43)32-37)36-19-17-33(18-20-36)16-14-12-10-8-6-4-2/h21-30,32-33,36H,3-20,31H2,1-2H3