[3-[4-(4-chloranylphenoxy)phenyl]-3-oxidanyl-butyl] hexanoate

Systemtic Name: [3-[4-(4-chloranylphenoxy)phenyl]-3-oxidanyl-butyl] hexanoate Openeye Name: [3-[4-(4-chlorophenoxy)phenyl]-3-hydroxy-butyl] hexanoate CAS Name: hexanoic acid [3-[4-(4-chlorophenoxy)phenyl]-3-hydroxybutyl] ester IUPAC Name: [3-[4-(4-chlorophenoxy)phenyl]-3-hydroxybutyl] hexanoate Traditional Name: hexanoic acid [3-[4-(4-chlorophenoxy)phenyl]-3-hydroxy-butyl] ester Formula: C22H27ClO4 MolecularWeight: 390.90038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OCCC(C)(C1=CC=C(C=C1)OC2=CC=C(C=C2)Cl)O

Isomeric SMILES

CCCCCC(=O)OCCC(C)(C1=CC=C(C=C1)OC2=CC=C(C=C2)Cl)O

InChI

InChI=1S/C22H27ClO4/c1-3-4-5-6-21(24)26-16-15-22(2,25)17-7-11-19(12-8-17)27-20-13-9-18(23)10-14-20/h7-14,25H,3-6,15-16H2,1-2H3