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4-(pyridin-1-ium-3-ylcarbonylamino)butanoic acid chloride

4-(pyridin-1-ium-3-ylcarbonylamino)butanoic acid chloride

Systemtic Name:4-(pyridin-1-ium-3-ylcarbonylamino)butanoic acid chloride
Openeye Name:4-(pyridin-1-ium-3-carbonylamino)butanoic acid chloride
CAS Name:4-[[oxo(3-pyridin-1-iumyl)methyl]amino]butanoic acid chloride
IUPAC Name:4-(pyridin-1-ium-3-carbonylamino)butanoic acid chloride
Traditional Name:4-(pyridin-1-ium-3-carbonylamino)butyric acid chloride
Formula: C10H13ClN2O3
MolecularWeight: 244.67482
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C10H12N2O3.ClH/c13-9(14)4-2-6-12-10(15)8-3-1-5-11-7-8;/h1,3,5,7H,2,4,6H2,(H,12,15)(H,13,14);1H


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