1-[4-bromanyl-2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]propan-1-one

Systemtic Name: 1-[4-bromanyl-2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]propan-1-one Openeye Name: 1-[4-bromo-2-(4,4-dimethyl-5H-oxazol-2-yl)phenyl]propan-1-one CAS Name: 1-[4-bromo-2-(4,4-dimethyl-5H-oxazol-2-yl)phenyl]-1-propanone IUPAC Name: 1-[4-bromo-2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]propan-1-one Traditional Name: 1-[4-bromo-2-(4,4-dimethyl-2-oxazolin-2-yl)phenyl]propan-1-one Formula: C14H16BrNO2 MolecularWeight: 310.18634

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C=C(C=C1)Br)C2=NC(CO2)(C)C

Isomeric SMILES

CCC(=O)C1=C(C=C(C=C1)Br)C2=NC(CO2)(C)C

InChI

InChI=1S/C14H16BrNO2/c1-4-12(17)10-6-5-9(15)7-11(10)13-16-14(2,3)8-18-13/h5-7H,4,8H2,1-3H3