(2R)-N-(3-methylbutyl)-2-piperazin-1-ium-1-yl-propanamide

Systemtic Name: (2R)-N-(3-methylbutyl)-2-piperazin-1-ium-1-yl-propanamide Openeye Name: (2R)-N-isopentyl-2-piperazin-1-ium-1-yl-propanamide CAS Name: (2R)-N-(3-methylbutyl)-2-(1-piperazin-1-iumyl)propanamide IUPAC Name: (2R)-N-(3-methylbutyl)-2-piperazin-1-ium-1-ylpropanamide Traditional Name: (2R)-N-isoamyl-2-piperazin-1-ium-1-yl-propionamide Formula: C12H26N3O+ MolecularWeight: 228.35434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C(C)[NH+]1CCNCC1

Isomeric SMILES

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

InChI

InChI=1S/C12H25N3O/c1-10(2)4-5-14-12(16)11(3)15-8-6-13-7-9-15/h10-11,13H,4-9H2,1-3H3,(H,14,16)/p+1/t11-/m1/s1