N-[[(2S)-butan-2-yl]carbamoyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-[[(2S)-butan-2-yl]carbamoyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide Openeye Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-[[(1S)-1-methylpropyl]carbamoyl]acetamide CAS Name: N-[[[(2S)-butan-2-yl]amino]-oxomethyl]-2-[(3S)-3-methyl-1-piperidin-1-iumyl]acetamide IUPAC Name: N-[[(2S)-butan-2-yl]carbamoyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Traditional Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-[[(1S)-1-methylpropyl]carbamoyl]acetamide Formula: C13H26N3O2+ MolecularWeight: 256.36444

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC(=O)C[NH+]1CCCC(C1)C

Isomeric SMILES

CC[C@H](C)NC(=O)NC(=O)C[NH+]1CCC[C@@H](C1)C

InChI

InChI=1S/C13H25N3O2/c1-4-11(3)14-13(18)15-12(17)9-16-7-5-6-10(2)8-16/h10-11H,4-9H2,1-3H3,(H2,14,15,17,18)/p+1/t10-,11-/m0/s1