[4-[(2S)-butan-2-yl]piperazin-1-ium-1-ylidene]methanediamine

Systemtic Name: [4-[(2S)-butan-2-yl]piperazin-1-ium-1-ylidene]methanediamine Openeye Name: [4-[(1S)-1-methylpropyl]piperazin-1-ium-1-ylidene]methanediamine CAS Name: [4-[(2S)-butan-2-yl]-1-piperazin-1-iumylidene]methanediamine IUPAC Name: [4-[(2S)-butan-2-yl]piperazin-1-ium-1-ylidene]methanediamine Traditional Name: [amino-[4-[(1S)-1-methylpropyl]piperazin-1-ium-1-ylidene]methyl]amine Formula: C9H21N4+ MolecularWeight: 185.28984

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1CC[N+](=C(N)N)CC1

Isomeric SMILES

CC[C@H](C)N1CC[N+](=C(N)N)CC1

InChI

InChI=1S/C9H20N4/c1-3-8(2)12-4-6-13(7-5-12)9(10)11/h8H,3-7H2,1-2H3,(H3,10,11)/p+1/t8-/m0/s1