[3-(2,2-dimethylpropoxy)phenyl]methyl 3-(3-chlorophenyl)-3-oxidanyl-propanoate

Systemtic Name: [3-(2,2-dimethylpropoxy)phenyl]methyl 3-(3-chlorophenyl)-3-oxidanyl-propanoate Openeye Name: [3-(2,2-dimethylpropoxy)phenyl]methyl 3-(3-chlorophenyl)-3-hydroxy-propanoate CAS Name: 3-(3-chlorophenyl)-3-hydroxypropanoic acid [3-(2,2-dimethylpropoxy)phenyl]methyl ester IUPAC Name: [3-(2,2-dimethylpropoxy)phenyl]methyl 3-(3-chlorophenyl)-3-hydroxypropanoate Traditional Name: 3-(3-chlorophenyl)-3-hydroxy-propionic acid (3-neopentyloxybenzyl) ester Formula: C21H25ClO4 MolecularWeight: 376.8738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)COC1=CC=CC(=C1)COC(=O)CC(C2=CC(=CC=C2)Cl)O

Isomeric SMILES

CC(C)(C)COC1=CC=CC(=C1)COC(=O)CC(C2=CC(=CC=C2)Cl)O

InChI

InChI=1S/C21H25ClO4/c1-21(2,3)14-26-18-9-4-6-15(10-18)13-25-20(24)12-19(23)16-7-5-8-17(22)11-16/h4-11,19,23H,12-14H2,1-3H3