N-(cyanomethyl)-2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]ethanamide

Systemtic Name: N-(cyanomethyl)-2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]ethanamide Openeye Name: N-(cyanomethyl)-2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]acetamide CAS Name: N-(cyanomethyl)-2-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propylamino]acetamide IUPAC Name: N-(cyanomethyl)-2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]acetamide Traditional Name: N-(cyanomethyl)-2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]acetamide Formula: C13H25N4O+ MolecularWeight: 253.3638

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNCC(=O)NCC#N

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNCC(=O)NCC#N

InChI

InChI=1S/C13H24N4O/c1-12-5-2-3-9-17(12)10-4-7-15-11-13(18)16-8-6-14/h12,15H,2-5,7-11H2,1H3,(H,16,18)/p+1/t12-/m0/s1