(2R)-2-(2,4,6-trimethylpyridin-1-ium-1-yl)butanoate

Systemtic Name: (2R)-2-(2,4,6-trimethylpyridin-1-ium-1-yl)butanoate Openeye Name: (2R)-2-(2,4,6-trimethylpyridin-1-ium-1-yl)butanoate CAS Name: (2R)-2-(2,4,6-trimethyl-1-pyridin-1-iumyl)butanoate IUPAC Name: (2R)-2-(2,4,6-trimethylpyridin-1-ium-1-yl)butanoate Traditional Name: (2R)-2-(2,4,6-trimethylpyridin-1-ium-1-yl)butyrate Formula: C12H17NO2 MolecularWeight: 207.26888

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])[N+]1=C(C=C(C=C1C)C)C

Isomeric SMILES

CC[C@H](C(=O)[O-])[N+]1=C(C=C(C=C1C)C)C

InChI

InChI=1S/C12H17NO2/c1-5-11(12(14)15)13-9(3)6-8(2)7-10(13)4/h6-7,11H,5H2,1-4H3/t11-/m1/s1