(phenylmethyl) 2-[4-[(4-chlorophenyl)methyl]phenoxy]-2-methyl-butanoate

Systemtic Name: (phenylmethyl) 2-[4-[(4-chlorophenyl)methyl]phenoxy]-2-methyl-butanoate Openeye Name: benzyl 2-[4-[(4-chlorophenyl)methyl]phenoxy]-2-methyl-butanoate CAS Name: 2-[4-[(4-chlorophenyl)methyl]phenoxy]-2-methylbutanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[4-[(4-chlorophenyl)methyl]phenoxy]-2-methylbutanoate Traditional Name: 2-[4-(4-chlorobenzyl)phenoxy]-2-methyl-butyric acid benzyl ester Formula: C25H25ClO3 MolecularWeight: 408.9172

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(=O)OCC1=CC=CC=C1)OC2=CC=C(C=C2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CCC(C)(C(=O)OCC1=CC=CC=C1)OC2=CC=C(C=C2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C25H25ClO3/c1-3-25(2,24(27)28-18-21-7-5-4-6-8-21)29-23-15-11-20(12-16-23)17-19-9-13-22(26)14-10-19/h4-16H,3,17-18H2,1-2H3