[2-(2,5-dimethylphenyl)-2-oxidanylidene-ethyl] 4-bromanylbenzoate

Systemtic Name: [2-(2,5-dimethylphenyl)-2-oxidanylidene-ethyl] 4-bromanylbenzoate Openeye Name: [2-(2,5-dimethylphenyl)-2-oxo-ethyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [2-(2,5-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethylphenyl)-2-oxoethyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [2-(2,5-dimethylphenyl)-2-keto-ethyl] ester Formula: C17H15BrO3 MolecularWeight: 347.2032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15BrO3/c1-11-3-4-12(2)15(9-11)16(19)10-21-17(20)13-5-7-14(18)8-6-13/h3-9H,10H2,1-2H3