[2-chloranyl-4-(2-methylbutanoyl)phenyl] 4-(4-octylphenyl)benzoate

Systemtic Name: [2-chloranyl-4-(2-methylbutanoyl)phenyl] 4-(4-octylphenyl)benzoate Openeye Name: [2-chloro-4-(2-methylbutanoyl)phenyl] 4-(4-octylphenyl)benzoate CAS Name: 4-(4-octylphenyl)benzoic acid [2-chloro-4-(2-methyl-1-oxobutyl)phenyl] ester IUPAC Name: [2-chloro-4-(2-methylbutanoyl)phenyl] 4-(4-octylphenyl)benzoate Traditional Name: 4-(4-octylphenyl)benzoic acid [2-chloro-4-(2-methylbutanoyl)phenyl] ester Formula: C32H37ClO3 MolecularWeight: 505.08738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)C(=O)C(C)CC)Cl

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)C(=O)C(C)CC)Cl

InChI

InChI=1S/C32H37ClO3/c1-4-6-7-8-9-10-11-24-12-14-25(15-13-24)26-16-18-27(19-17-26)32(35)36-30-21-20-28(22-29(30)33)31(34)23(3)5-2/h12-23H,4-11H2,1-3H3