N-methyl-N-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]-1-oxidanidyl-pyridin-1-ium-4-carboxamide

Systemtic Name: N-methyl-N-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]-1-oxidanidyl-pyridin-1-ium-4-carboxamide Openeye Name: N-methyl-N-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]-1-oxido-pyridin-1-ium-4-carboxamide CAS Name: N-methyl-N-[[(2S)-1-methyl-2-piperidin-1-iumyl]methyl]-1-oxido-4-pyridin-1-iumcarboxamide IUPAC Name: N-methyl-N-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]-1-oxidopyridin-1-ium-4-carboxamide Traditional Name: N-methyl-N-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]-1-oxido-pyridin-1-ium-4-carboxamide Formula: C14H22N3O2+ MolecularWeight: 264.34338

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCCC1CN(C)C(=O)C2=CC=[N+](C=C2)[O-]

Isomeric SMILES

C[NH+]1CCCC[C@H]1CN(C)C(=O)C2=CC=[N+](C=C2)[O-]

InChI

InChI=1S/C14H21N3O2/c1-15-8-4-3-5-13(15)11-16(2)14(18)12-6-9-17(19)10-7-12/h6-7,9-10,13H,3-5,8,11H2,1-2H3/p+1/t13-/m0/s1