(2S)-N-(2,4-dimethylpyrazol-3-yl)-1-ethyl-piperidin-1-ium-2-carboxamide

Systemtic Name: (2S)-N-(2,4-dimethylpyrazol-3-yl)-1-ethyl-piperidin-1-ium-2-carboxamide Openeye Name: (2S)-N-(2,4-dimethylpyrazol-3-yl)-1-ethyl-piperidin-1-ium-2-carboxamide CAS Name: (2S)-N-(2,4-dimethyl-3-pyrazolyl)-1-ethyl-2-piperidin-1-iumcarboxamide IUPAC Name: (2S)-N-(2,4-dimethylpyrazol-3-yl)-1-ethylpiperidin-1-ium-2-carboxamide Traditional Name: (2S)-N-(2,4-dimethylpyrazol-3-yl)-1-ethyl-piperidin-1-ium-2-carboxamide Formula: C13H23N4O+ MolecularWeight: 251.34792

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCCC1C(=O)NC2=C(C=NN2C)C

Isomeric SMILES

CC[NH+]1CCCC[C@H]1C(=O)NC2=C(C=NN2C)C

InChI

InChI=1S/C13H22N4O/c1-4-17-8-6-5-7-11(17)13(18)15-12-10(2)9-14-16(12)3/h9,11H,4-8H2,1-3H3,(H,15,18)/p+1/t11-/m0/s1