5-bromanyl-3-methyl-2-oxidanidyl-1,2-benzoxazol-2-ium

Systemtic Name: 5-bromanyl-3-methyl-2-oxidanidyl-1,2-benzoxazol-2-ium Openeye Name: 5-bromo-3-methyl-2-oxido-1,2-benzoxazol-2-ium CAS Name: 5-bromo-3-methyl-2-oxido-1,2-benzoxazol-2-ium IUPAC Name: 5-bromo-3-methyl-2-oxido-1,2-benzoxazol-2-ium Traditional Name: 5-bromo-3-methyl-2-oxido-indoxazen-2-ium Formula: C8H6BrNO2 MolecularWeight: 228.04274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](OC2=C1C=C(C=C2)Br)[O-]

Isomeric SMILES

CC1=[N+](OC2=C1C=C(C=C2)Br)[O-]

InChI

InChI=1S/C8H6BrNO2/c1-5-7-4-6(9)2-3-8(7)12-10(5)11/h2-4H,1H3