(4-octoxyphenyl) 3-chloranyl-4-(4-pentylphenyl)carbonyloxy-benzoate

Systemtic Name: (4-octoxyphenyl) 3-chloranyl-4-(4-pentylphenyl)carbonyloxy-benzoate Openeye Name: (4-octoxyphenyl) 3-chloro-4-(4-pentylbenzoyl)oxy-benzoate CAS Name: 3-chloro-4-[oxo-(4-pentylphenyl)methoxy]benzoic acid (4-octoxyphenyl) ester IUPAC Name: (4-octoxyphenyl) 3-chloro-4-(4-pentylbenzoyl)oxybenzoate Traditional Name: 4-(4-amylbenzoyl)oxy-3-chloro-benzoic acid (4-octoxyphenyl) ester Formula: C33H39ClO5 MolecularWeight: 551.11276

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCCC)Cl

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCCC)Cl

InChI

InChI=1S/C33H39ClO5/c1-3-5-7-8-9-11-23-37-28-18-20-29(21-19-28)38-33(36)27-17-22-31(30(34)24-27)39-32(35)26-15-13-25(14-16-26)12-10-6-4-2/h13-22,24H,3-12,23H2,1-2H3