4-bromanyl-4-[4-[(4-chlorophenyl)methyl]phenoxy]-2,2-dimethyl-3-oxidanylidene-butanoic acid

Systemtic Name: 4-bromanyl-4-[4-[(4-chlorophenyl)methyl]phenoxy]-2,2-dimethyl-3-oxidanylidene-butanoic acid Openeye Name: 4-bromo-4-[4-[(4-chlorophenyl)methyl]phenoxy]-2,2-dimethyl-3-oxo-butanoic acid CAS Name: 4-bromo-4-[4-[(4-chlorophenyl)methyl]phenoxy]-2,2-dimethyl-3-oxobutanoic acid IUPAC Name: 4-bromo-4-[4-[(4-chlorophenyl)methyl]phenoxy]-2,2-dimethyl-3-oxobutanoic acid Traditional Name: 4-bromo-4-[4-(4-chlorobenzyl)phenoxy]-3-keto-2,2-dimethyl-butyric acid Formula: C19H18BrClO4 MolecularWeight: 425.70082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)C(OC1=CC=C(C=C1)CC2=CC=C(C=C2)Cl)Br)C(=O)O

Isomeric SMILES

CC(C)(C(=O)C(OC1=CC=C(C=C1)CC2=CC=C(C=C2)Cl)Br)C(=O)O

InChI

InChI=1S/C19H18BrClO4/c1-19(2,18(23)24)16(22)17(20)25-15-9-5-13(6-10-15)11-12-3-7-14(21)8-4-12/h3-10,17H,11H2,1-2H3,(H,23,24)