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6-(5,6-dimethoxy-2-methyl-1,3-benzoxazol-3-ium-3-yl)hexanoic acid bromide

6-(5,6-dimethoxy-2-methyl-1,3-benzoxazol-3-ium-3-yl)hexanoic acid bromide

Systemtic Name:6-(5,6-dimethoxy-2-methyl-1,3-benzoxazol-3-ium-3-yl)hexanoic acid bromide
Openeye Name:6-(5,6-dimethoxy-2-methyl-1,3-benzoxazol-3-ium-3-yl)hexanoic acid bromide
CAS Name:6-(5,6-dimethoxy-2-methyl-1,3-benzoxazol-3-ium-3-yl)hexanoic acid bromide
IUPAC Name:6-(5,6-dimethoxy-2-methyl-1,3-benzoxazol-3-ium-3-yl)hexanoic acid bromide
Traditional Name:6-(5,6-dimethoxy-2-methyl-1,3-benzoxazol-3-ium-3-yl)hexanoic acid bromide
Formula: C16H22BrNO5
MolecularWeight: 388.25358
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C16H21NO5.BrH/c1-11-17(8-6-4-5-7-16(18)19)12-9-14(20-2)15(21-3)10-13(12)22-11;/h9-10H,4-8H2,1-3H3;1H


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