[4-bromanyl-4-(4-chloranylphenoxy)-2,2-dimethyl-3-oxidanylidene-butyl] benzoate

Systemtic Name: [4-bromanyl-4-(4-chloranylphenoxy)-2,2-dimethyl-3-oxidanylidene-butyl] benzoate Openeye Name: [4-bromo-4-(4-chlorophenoxy)-2,2-dimethyl-3-oxo-butyl] benzoate CAS Name: benzoic acid [4-bromo-4-(4-chlorophenoxy)-2,2-dimethyl-3-oxobutyl] ester IUPAC Name: [4-bromo-4-(4-chlorophenoxy)-2,2-dimethyl-3-oxobutyl] benzoate Traditional Name: benzoic acid [4-bromo-4-(4-chlorophenoxy)-3-keto-2,2-dimethyl-butyl] ester Formula: C19H18BrClO4 MolecularWeight: 425.70082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(COC(=O)C1=CC=CC=C1)C(=O)C(OC2=CC=C(C=C2)Cl)Br

Isomeric SMILES

CC(C)(COC(=O)C1=CC=CC=C1)C(=O)C(OC2=CC=C(C=C2)Cl)Br

InChI

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