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

Systemtic Name: [3-[4-(4-chloranylphenoxy)phenyl]-3-oxidanyl-butyl] 4-methylpentanoate Openeye Name: [3-[4-(4-chlorophenoxy)phenyl]-3-hydroxy-butyl] 4-methylpentanoate CAS Name: 4-methylpentanoic acid [3-[4-(4-chlorophenoxy)phenyl]-3-hydroxybutyl] ester IUPAC Name: [3-[4-(4-chlorophenoxy)phenyl]-3-hydroxybutyl] 4-methylpentanoate Traditional Name: 4-methylvaleric 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)CCC(=O)OCCC(C)(C1=CC=C(C=C1)OC2=CC=C(C=C2)Cl)O

Isomeric SMILES

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

InChI

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