[(2S)-1-[4-[(2S)-butan-2-yl]piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: [(2S)-1-[4-[(2S)-butan-2-yl]piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1S)-2-methyl-1-[4-[(1S)-1-methylpropyl]piperazine-1-carbonyl]propyl]ammonium CAS Name: [(2S)-1-[4-[(2S)-butan-2-yl]-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-1-[4-[(2S)-butan-2-yl]piperazin-1-yl]-3-methyl-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-2-methyl-1-[4-[(1S)-1-methylpropyl]piperazine-1-carbonyl]propyl]ammonium Formula: C13H28N3O+ MolecularWeight: 242.38092

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1CCN(CC1)C(=O)C(C(C)C)[NH3+]

Isomeric SMILES

CC[C@H](C)N1CCN(CC1)C(=O)[C@H](C(C)C)[NH3+]

InChI

InChI=1S/C13H27N3O/c1-5-11(4)15-6-8-16(9-7-15)13(17)12(14)10(2)3/h10-12H,5-9,14H2,1-4H3/p+1/t11-,12-/m0/s1