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3-(1,4-dimethylpyridin-1-ium-3-yl)propanoic acid

3-(1,4-dimethylpyridin-1-ium-3-yl)propanoic acid

Systemtic Name:3-(1,4-dimethylpyridin-1-ium-3-yl)propanoic acid
Openeye Name:3-(1,4-dimethylpyridin-1-ium-3-yl)propanoic acid
CAS Name:3-(1,4-dimethyl-3-pyridin-1-iumyl)propanoic acid
IUPAC Name:3-(1,4-dimethylpyridin-1-ium-3-yl)propanoic acid
Traditional Name:3-(1,4-dimethylpyridin-1-ium-3-yl)propionic acid
Formula: C10H14NO2+
MolecularWeight: 180.22366
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=[N+](C=C1)C)CCC(=O)O


Isomeric SMILES

CC1=C(C=[N+](C=C1)C)CCC(=O)O


InChI

InChI=1S/C10H13NO2/c1-8-5-6-11(2)7-9(8)3-4-10(12)13/h5-7H,3-4H2,1-2H3/p+1


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