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2-(2-methyl-1,3-benzoxazol-3-ium-3-yl)propanoic acid bromide

2-(2-methyl-1,3-benzoxazol-3-ium-3-yl)propanoic acid bromide

Systemtic Name:2-(2-methyl-1,3-benzoxazol-3-ium-3-yl)propanoic acid bromide
Openeye Name:2-(2-methyl-1,3-benzoxazol-3-ium-3-yl)propanoic acid bromide
CAS Name:2-(2-methyl-1,3-benzoxazol-3-ium-3-yl)propanoic acid bromide
IUPAC Name:2-(2-methyl-1,3-benzoxazol-3-ium-3-yl)propanoic acid bromide
Traditional Name:2-(2-methyl-1,3-benzoxazol-3-ium-3-yl)propionic acid bromide
Formula: C11H12BrNO3
MolecularWeight: 286.12188
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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=CC=CC=C2O1)C(C)C(=O)O.[Br-]


Isomeric SMILES

CC1=[N+](C2=CC=CC=C2O1)C(C)C(=O)O.[Br-]


InChI

InChI=1S/C11H11NO3.BrH/c1-7(11(13)14)12-8(2)15-10-6-4-3-5-9(10)12;/h3-7H,1-2H3;1H


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