[1-[[[(2S)-butan-2-yl]azaniumyl]methyl]cyclohexyl]-dimethyl-azanium

Systemtic Name: [1-[[[(2S)-butan-2-yl]azaniumyl]methyl]cyclohexyl]-dimethyl-azanium Openeye Name: dimethyl-[1-[[[(1S)-1-methylpropyl]ammonio]methyl]cyclohexyl]ammonium CAS Name: [1-[[[(2S)-butan-2-yl]ammonio]methyl]cyclohexyl]-dimethylammonium IUPAC Name: [1-[[[(2S)-butan-2-yl]azaniumyl]methyl]cyclohexyl]-dimethylazanium Traditional Name: dimethyl-[1-[[[(1S)-1-methylpropyl]ammonio]methyl]cyclohexyl]ammonium Formula: C13H30N2+2 MolecularWeight: 214.3907

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CC1(CCCCC1)[NH+](C)C

Isomeric SMILES

CC[C@H](C)[NH2+]CC1(CCCCC1)[NH+](C)C

InChI

InChI=1S/C13H28N2/c1-5-12(2)14-11-13(15(3)4)9-7-6-8-10-13/h12,14H,5-11H2,1-4H3/p+2/t12-/m0/s1