[(2S,3S)-3-methylpentan-2-yl]-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]azanium

Systemtic Name: [(2S,3S)-3-methylpentan-2-yl]-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]azanium Openeye Name: [(1S,2S)-1,2-dimethylbutyl]-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]ammonium CAS Name: [(2S,3S)-3-methylpentan-2-yl]-[[1-(1-piperidin-1-iumyl)cyclohexyl]methyl]ammonium IUPAC Name: [(2S,3S)-3-methylpentan-2-yl]-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]azanium Traditional Name: [(1S,2S)-1,2-dimethylbutyl]-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]ammonium Formula: C18H38N2+2 MolecularWeight: 282.50772

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C)[NH2+]CC1(CCCCC1)[NH+]2CCCCC2

Isomeric SMILES

CC[C@H](C)[C@H](C)[NH2+]CC1(CCCCC1)[NH+]2CCCCC2

InChI

InChI=1S/C18H36N2/c1-4-16(2)17(3)19-15-18(11-7-5-8-12-18)20-13-9-6-10-14-20/h16-17,19H,4-15H2,1-3H3/p+2/t16-,17-/m0/s1