[(1S,2S,5S)-2-azaniumyl-5-ethyl-cyclohexyl]-methyl-(2-pyridin-2-ylethyl)azanium

Systemtic Name: [(1S,2S,5S)-2-azaniumyl-5-ethyl-cyclohexyl]-methyl-(2-pyridin-2-ylethyl)azanium Openeye Name: [(1S,2S,5S)-2-azaniumyl-5-ethyl-cyclohexyl]-methyl-[2-(2-pyridyl)ethyl]ammonium CAS Name: [(1S,2S,5S)-2-ammonio-5-ethylcyclohexyl]-methyl-[2-(2-pyridinyl)ethyl]ammonium IUPAC Name: [(1S,2S,5S)-2-azaniumyl-5-ethylcyclohexyl]-methyl-(2-pyridin-2-ylethyl)azanium Traditional Name: [(1S,2S,5S)-2-ammonio-5-ethyl-cyclohexyl]-methyl-[2-(2-pyridyl)ethyl]ammonium Formula: C16H29N3+2 MolecularWeight: 263.42156

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(C(C1)[NH+](C)CCC2=CC=CC=N2)[NH3+]

Isomeric SMILES

CC[C@H]1CC[C@@H]([C@H](C1)[NH+](C)CCC2=CC=CC=N2)[NH3+]

InChI

InChI=1S/C16H27N3/c1-3-13-7-8-15(17)16(12-13)19(2)11-9-14-6-4-5-10-18-14/h4-6,10,13,15-16H,3,7-9,11-12,17H2,1-2H3/p+2/t13-,15-,16-/m0/s1