2-[3-(4-chlorophenyl)-5-propoxy-phenyl]hexanoic acid

Systemtic Name: 2-[3-(4-chlorophenyl)-5-propoxy-phenyl]hexanoic acid Openeye Name: 2-[3-(4-chlorophenyl)-5-propoxy-phenyl]hexanoic acid CAS Name: 2-[3-(4-chlorophenyl)-5-propoxyphenyl]hexanoic acid IUPAC Name: 2-[3-(4-chlorophenyl)-5-propoxyphenyl]hexanoic acid Traditional Name: 2-[3-(4-chlorophenyl)-5-propoxy-phenyl]hexanoic acid Formula: C21H25ClO3 MolecularWeight: 360.8744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC(=CC(=C1)C2=CC=C(C=C2)Cl)OCCC)C(=O)O

Isomeric SMILES

CCCCC(C1=CC(=CC(=C1)C2=CC=C(C=C2)Cl)OCCC)C(=O)O

InChI

InChI=1S/C21H25ClO3/c1-3-5-6-20(21(23)24)17-12-16(13-19(14-17)25-11-4-2)15-7-9-18(22)10-8-15/h7-10,12-14,20H,3-6,11H2,1-2H3,(H,23,24)