2-(2,3-dimethylpyridin-1-ium-1-yl)-N-[(2S)-pentan-2-yl]ethanamide

Systemtic Name: 2-(2,3-dimethylpyridin-1-ium-1-yl)-N-[(2S)-pentan-2-yl]ethanamide Openeye Name: 2-(2,3-dimethylpyridin-1-ium-1-yl)-N-[(1S)-1-methylbutyl]acetamide CAS Name: 2-(2,3-dimethyl-1-pyridin-1-iumyl)-N-[(2S)-pentan-2-yl]acetamide IUPAC Name: 2-(2,3-dimethylpyridin-1-ium-1-yl)-N-[(2S)-pentan-2-yl]acetamide Traditional Name: 2-(2,3-dimethylpyridin-1-ium-1-yl)-N-[(1S)-1-methylbutyl]acetamide Formula: C14H23N2O+ MolecularWeight: 235.34522

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)C[N+]1=CC=CC(=C1C)C

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2O/c1-5-7-12(3)15-14(17)10-16-9-6-8-11(2)13(16)4/h6,8-9,12H,5,7,10H2,1-4H3/p+1/t12-/m0/s1