(4-pentoxyphenyl) 4-(3-chloranyl-4-octyl-phenyl)benzoate

Systemtic Name: (4-pentoxyphenyl) 4-(3-chloranyl-4-octyl-phenyl)benzoate Openeye Name: (4-pentoxyphenyl) 4-(3-chloro-4-octyl-phenyl)benzoate CAS Name: 4-(3-chloro-4-octylphenyl)benzoic acid (4-pentoxyphenyl) ester IUPAC Name: (4-pentoxyphenyl) 4-(3-chloro-4-octylphenyl)benzoate Traditional Name: 4-(3-chloro-4-octyl-phenyl)benzoic acid (4-amoxyphenyl) ester Formula: C32H39ClO3 MolecularWeight: 507.10326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H39ClO3/c1-3-5-7-8-9-10-12-26-15-18-28(24-31(26)33)25-13-16-27(17-14-25)32(34)36-30-21-19-29(20-22-30)35-23-11-6-4-2/h13-22,24H,3-12,23H2,1-2H3