N-[(2S)-pentan-2-yl]-2-piperazin-1-ium-1-yl-ethanamide

Systemtic Name: N-[(2S)-pentan-2-yl]-2-piperazin-1-ium-1-yl-ethanamide Openeye Name: N-[(1S)-1-methylbutyl]-2-piperazin-1-ium-1-yl-acetamide CAS Name: N-[(2S)-pentan-2-yl]-2-(1-piperazin-1-iumyl)acetamide IUPAC Name: N-[(2S)-pentan-2-yl]-2-piperazin-1-ium-1-ylacetamide Traditional Name: N-[(1S)-1-methylbutyl]-2-piperazin-1-ium-1-yl-acetamide Formula: C11H24N3O+ MolecularWeight: 214.32776

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)C[NH+]1CCNCC1

Isomeric SMILES

CCC[C@H](C)NC(=O)C[NH+]1CCNCC1

InChI

InChI=1S/C11H23N3O/c1-3-4-10(2)13-11(15)9-14-7-5-12-6-8-14/h10,12H,3-9H2,1-2H3,(H,13,15)/p+1/t10-/m0/s1