[(2R)-1-(4-bromophenyl)-1-oxidanylidene-propan-2-yl] 2,5-dimethylbenzoate

Systemtic Name: [(2R)-1-(4-bromophenyl)-1-oxidanylidene-propan-2-yl] 2,5-dimethylbenzoate Openeye Name: [(1R)-2-(4-bromophenyl)-1-methyl-2-oxo-ethyl] 2,5-dimethylbenzoate CAS Name: 2,5-dimethylbenzoic acid [(2R)-1-(4-bromophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-bromophenyl)-1-oxopropan-2-yl] 2,5-dimethylbenzoate Traditional Name: 2,5-dimethylbenzoic acid [(1R)-2-(4-bromophenyl)-2-keto-1-methyl-ethyl] ester Formula: C18H17BrO3 MolecularWeight: 361.22978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)OC(C)C(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)O[C@H](C)C(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C18H17BrO3/c1-11-4-5-12(2)16(10-11)18(21)22-13(3)17(20)14-6-8-15(19)9-7-14/h4-10,13H,1-3H3/t13-/m1/s1