8-(4-chlorophenyl)-2-phenethyloxy-octanoic acid

Systemtic Name: 8-(4-chlorophenyl)-2-phenethyloxy-octanoic acid Openeye Name: 8-(4-chlorophenyl)-2-phenethyloxy-octanoic acid CAS Name: 8-(4-chlorophenyl)-2-phenethyloxyoctanoic acid IUPAC Name: 8-(4-chlorophenyl)-2-phenethyloxyoctanoic acid Traditional Name: 8-(4-chlorophenyl)-2-phenethyloxy-caprylic acid Formula: C22H27ClO3 MolecularWeight: 374.90098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC(CCCCCCC2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCOC(CCCCCCC2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C22H27ClO3/c23-20-14-12-19(13-15-20)10-4-1-2-7-11-21(22(24)25)26-17-16-18-8-5-3-6-9-18/h3,5-6,8-9,12-15,21H,1-2,4,7,10-11,16-17H2,(H,24,25)