(3-chloranyl-4-dodecoxy-phenyl) 4-acetyloxybenzoate

Systemtic Name: (3-chloranyl-4-dodecoxy-phenyl) 4-acetyloxybenzoate Openeye Name: (3-chloro-4-dodecoxy-phenyl) 4-acetoxybenzoate CAS Name: 4-acetyloxybenzoic acid (3-chloro-4-dodecoxyphenyl) ester IUPAC Name: (3-chloro-4-dodecoxyphenyl) 4-acetyloxybenzoate Traditional Name: 4-acetoxybenzoic acid (3-chloro-4-lauryloxy-phenyl) ester Formula: C27H35ClO5 MolecularWeight: 475.0168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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