2-(4-bromophenyl)-5,5-dimethyl-1,3-oxazol-3-ium-4-one

Systemtic Name: 2-(4-bromophenyl)-5,5-dimethyl-1,3-oxazol-3-ium-4-one Openeye Name: 2-(4-bromophenyl)-5,5-dimethyl-oxazol-3-ium-4-one CAS Name: 2-(4-bromophenyl)-5,5-dimethyl-4-oxazol-3-iumone IUPAC Name: 2-(4-bromophenyl)-5,5-dimethyl-1,3-oxazol-3-ium-4-one Traditional Name: 2-(4-bromophenyl)-5,5-dimethyl-2-oxazolin-3-ium-4-one Formula: C11H11BrNO2+ MolecularWeight: 269.11454

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)[NH+]=C(O1)C2=CC=C(C=C2)Br)C

Isomeric SMILES

CC1(C(=O)[NH+]=C(O1)C2=CC=C(C=C2)Br)C

InChI

InChI=1S/C11H10BrNO2/c1-11(2)10(14)13-9(15-11)7-3-5-8(12)6-4-7/h3-6H,1-2H3/p+1