(2S)-2-methyl-N-[[(2R)-piperidin-1-ium-2-yl]methyl]pentanamide

Systemtic Name: (2S)-2-methyl-N-[[(2R)-piperidin-1-ium-2-yl]methyl]pentanamide Openeye Name: (2S)-2-methyl-N-[[(2R)-piperidin-1-ium-2-yl]methyl]pentanamide CAS Name: (2S)-2-methyl-N-[[(2R)-2-piperidin-1-iumyl]methyl]pentanamide IUPAC Name: (2S)-2-methyl-N-[[(2R)-piperidin-1-ium-2-yl]methyl]pentanamide Traditional Name: (2S)-2-methyl-N-[[(2R)-piperidin-1-ium-2-yl]methyl]valeramide Formula: C12H25N2O+ MolecularWeight: 213.3397

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C(=O)NCC1CCCC[NH2+]1

Isomeric SMILES

CCC[C@H](C)C(=O)NC[C@H]1CCCC[NH2+]1

InChI

InChI=1S/C12H24N2O/c1-3-6-10(2)12(15)14-9-11-7-4-5-8-13-11/h10-11,13H,3-9H2,1-2H3,(H,14,15)/p+1/t10-,11+/m0/s1