[(2S)-1-(azocan-1-ium-1-yl)-3,3-dimethyl-butan-2-yl]azanium

Systemtic Name: [(2S)-1-(azocan-1-ium-1-yl)-3,3-dimethyl-butan-2-yl]azanium Openeye Name: [(1S)-1-(azocan-1-ium-1-ylmethyl)-2,2-dimethyl-propyl]ammonium CAS Name: [(2S)-1-(1-azocan-1-iumyl)-3,3-dimethylbutan-2-yl]ammonium IUPAC Name: [(2S)-1-(azocan-1-ium-1-yl)-3,3-dimethylbutan-2-yl]azanium Traditional Name: [(1S)-1-(azocan-1-ium-1-ylmethyl)-2,2-dimethyl-propyl]ammonium Formula: C13H30N2+2 MolecularWeight: 214.3907

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C[NH+]1CCCCCCC1)[NH3+]

Isomeric SMILES

CC(C)(C)[C@@H](C[NH+]1CCCCCCC1)[NH3+]

InChI

InChI=1S/C13H28N2/c1-13(2,3)12(14)11-15-9-7-5-4-6-8-10-15/h12H,4-11,14H2,1-3H3/p+2/t12-/m1/s1