(2S)-N-butyl-2-(1,4-diazepan-4-ium-1-yl)propanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(C)N1CCC[NH2+]CC1

Isomeric SMILES

CCCCNC(=O)[C@H](C)N1CCC[NH2+]CC1

InChI

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