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3-methyl-2-(pyridin-1-ium-3-ylcarbonylamino)butanoic acid chloride

3-methyl-2-(pyridin-1-ium-3-ylcarbonylamino)butanoic acid chloride

Systemtic Name:3-methyl-2-(pyridin-1-ium-3-ylcarbonylamino)butanoic acid chloride
Openeye Name:3-methyl-2-(pyridin-1-ium-3-carbonylamino)butanoic acid chloride
CAS Name:3-methyl-2-[[oxo(3-pyridin-1-iumyl)methyl]amino]butanoic acid chloride
IUPAC Name:3-methyl-2-(pyridin-1-ium-3-carbonylamino)butanoic acid chloride
Traditional Name:3-methyl-2-(pyridin-1-ium-3-carbonylamino)butyric acid chloride
Formula: C11H15ClN2O3
MolecularWeight: 258.7014
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C1=C[NH+]=CC=C1.[Cl-]


Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)C1=C[NH+]=CC=C1.[Cl-]


InChI

InChI=1S/C11H14N2O3.ClH/c1-7(2)9(11(15)16)13-10(14)8-4-3-5-12-6-8;/h3-7,9H,1-2H3,(H,13,14)(H,15,16);1H


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