2-bromanyl-1-[3-(3,4-dimethylphenyl)-1,2-oxazol-5-yl]ethanone

Systemtic Name: 2-bromanyl-1-[3-(3,4-dimethylphenyl)-1,2-oxazol-5-yl]ethanone Openeye Name: 2-bromo-1-[3-(3,4-dimethylphenyl)isoxazol-5-yl]ethanone CAS Name: 2-bromo-1-[3-(3,4-dimethylphenyl)-5-isoxazolyl]ethanone IUPAC Name: 2-bromo-1-[3-(3,4-dimethylphenyl)-1,2-oxazol-5-yl]ethanone Traditional Name: 2-bromo-1-[3-(3,4-dimethylphenyl)isoxazol-5-yl]ethanone Formula: C13H12BrNO2 MolecularWeight: 294.14388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NOC(=C2)C(=O)CBr)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NOC(=C2)C(=O)CBr)C

InChI

InChI=1S/C13H12BrNO2/c1-8-3-4-10(5-9(8)2)11-6-13(17-15-11)12(16)7-14/h3-6H,7H2,1-2H3