4-(4-chloranylphenoxy)-2-phenoxy-octanoic acid

Systemtic Name: 4-(4-chloranylphenoxy)-2-phenoxy-octanoic acid Openeye Name: 4-(4-chlorophenoxy)-2-phenoxy-octanoic acid CAS Name: 4-(4-chlorophenoxy)-2-phenoxyoctanoic acid IUPAC Name: 4-(4-chlorophenoxy)-2-phenoxyoctanoic acid Traditional Name: 4-(4-chlorophenoxy)-2-phenoxy-caprylic acid Formula: C20H23ClO4 MolecularWeight: 362.84722

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(C(=O)O)OC1=CC=CC=C1)OC2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCC(CC(C(=O)O)OC1=CC=CC=C1)OC2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H23ClO4/c1-2-3-7-18(24-17-12-10-15(21)11-13-17)14-19(20(22)23)25-16-8-5-4-6-9-16/h4-6,8-13,18-19H,2-3,7,14H2,1H3,(H,22,23)