[3-[4-(4-chloranylphenoxy)phenyl]-3-oxidanyl-butyl] 3,3-dimethylbutanoate

Systemtic Name: [3-[4-(4-chloranylphenoxy)phenyl]-3-oxidanyl-butyl] 3,3-dimethylbutanoate Openeye Name: [3-[4-(4-chlorophenoxy)phenyl]-3-hydroxy-butyl] 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid [3-[4-(4-chlorophenoxy)phenyl]-3-hydroxybutyl] ester IUPAC Name: [3-[4-(4-chlorophenoxy)phenyl]-3-hydroxybutyl] 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric 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:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27ClO4/c1-21(2,3)15-20(24)26-14-13-22(4,25)16-5-9-18(10-6-16)27-19-11-7-17(23)8-12-19/h5-12,25H,13-15H2,1-4H3