(2S)-N-butyl-N-methyl-2-piperazin-4-ium-1-yl-propanamide

Systemtic Name: (2S)-N-butyl-N-methyl-2-piperazin-4-ium-1-yl-propanamide Openeye Name: (2S)-N-butyl-N-methyl-2-piperazin-4-ium-1-yl-propanamide CAS Name: (2S)-N-butyl-N-methyl-2-(1-piperazin-4-iumyl)propanamide IUPAC Name: (2S)-N-butyl-N-methyl-2-piperazin-4-ium-1-ylpropanamide Traditional Name: (2S)-N-butyl-N-methyl-2-piperazin-4-ium-1-yl-propionamide Formula: C12H26N3O+ MolecularWeight: 228.35434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)C(C)N1CC[NH2+]CC1

Isomeric SMILES

CCCCN(C)C(=O)[C@H](C)N1CC[NH2+]CC1

InChI

InChI=1S/C12H25N3O/c1-4-5-8-14(3)12(16)11(2)15-9-6-13-7-10-15/h11,13H,4-10H2,1-3H3/p+1/t11-/m0/s1