(4-dodecoxyphenyl) 4-acetyloxy-3-chloranyl-benzoate

Systemtic Name: (4-dodecoxyphenyl) 4-acetyloxy-3-chloranyl-benzoate Openeye Name: (4-dodecoxyphenyl) 4-acetoxy-3-chloro-benzoate CAS Name: 4-acetyloxy-3-chlorobenzoic acid (4-dodecoxyphenyl) ester IUPAC Name: (4-dodecoxyphenyl) 4-acetyloxy-3-chlorobenzoate Traditional Name: 4-acetoxy-3-chloro-benzoic acid (4-lauryloxyphenyl) ester Formula: C27H35ClO5 MolecularWeight: 475.0168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)OC(=O)C)Cl

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)OC(=O)C)Cl

InChI

InChI=1S/C27H35ClO5/c1-3-4-5-6-7-8-9-10-11-12-19-31-23-14-16-24(17-15-23)33-27(30)22-13-18-26(25(28)20-22)32-21(2)29/h13-18,20H,3-12,19H2,1-2H3