[(2R)-1-(4-bromophenyl)-1-oxidanylidene-propan-2-yl] 2-(4-tert-butylphenoxy)ethanoate

Systemtic Name: [(2R)-1-(4-bromophenyl)-1-oxidanylidene-propan-2-yl] 2-(4-tert-butylphenoxy)ethanoate Openeye Name: [(1R)-2-(4-bromophenyl)-1-methyl-2-oxo-ethyl] 2-(4-tert-butylphenoxy)acetate CAS Name: 2-(4-tert-butylphenoxy)acetic acid [(2R)-1-(4-bromophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-bromophenyl)-1-oxopropan-2-yl] 2-(4-tert-butylphenoxy)acetate Traditional Name: 2-(4-tert-butylphenoxy)acetic acid [(1R)-2-(4-bromophenyl)-2-keto-1-methyl-ethyl] ester Formula: C21H23BrO4 MolecularWeight: 419.30892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)Br)OC(=O)COC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

C[C@H](C(=O)C1=CC=C(C=C1)Br)OC(=O)COC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C21H23BrO4/c1-14(20(24)15-5-9-17(22)10-6-15)26-19(23)13-25-18-11-7-16(8-12-18)21(2,3)4/h5-12,14H,13H2,1-4H3/t14-/m1/s1