[2-(3-bromophenyl)-2-oxidanylidene-ethyl] 3-(4-tert-butylphenoxy)propanoate

Systemtic Name: [2-(3-bromophenyl)-2-oxidanylidene-ethyl] 3-(4-tert-butylphenoxy)propanoate Openeye Name: [2-(3-bromophenyl)-2-oxo-ethyl] 3-(4-tert-butylphenoxy)propanoate CAS Name: 3-(4-tert-butylphenoxy)propanoic acid [2-(3-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-bromophenyl)-2-oxoethyl] 3-(4-tert-butylphenoxy)propanoate Traditional Name: 3-(4-tert-butylphenoxy)propionic acid [2-(3-bromophenyl)-2-keto-ethyl] ester Formula: C21H23BrO4 MolecularWeight: 419.30892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCCC(=O)OCC(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCCC(=O)OCC(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C21H23BrO4/c1-21(2,3)16-7-9-18(10-8-16)25-12-11-20(24)26-14-19(23)15-5-4-6-17(22)13-15/h4-10,13H,11-12,14H2,1-3H3