[(1S,2S,4S)-2-(azepan-1-ium-1-yl)-4-tert-butyl-cyclohexyl]azanium

Systemtic Name: [(1S,2S,4S)-2-(azepan-1-ium-1-yl)-4-tert-butyl-cyclohexyl]azanium Openeye Name: [(1S,2S,4S)-2-(azepan-1-ium-1-yl)-4-tert-butyl-cyclohexyl]ammonium CAS Name: [(1S,2S,4S)-2-(1-azepan-1-iumyl)-4-tert-butylcyclohexyl]ammonium IUPAC Name: [(1S,2S,4S)-2-(azepan-1-ium-1-yl)-4-tert-butylcyclohexyl]azanium Traditional Name: [(1S,2S,4S)-2-(azepan-1-ium-1-yl)-4-tert-butyl-cyclohexyl]ammonium Formula: C16H34N2+2 MolecularWeight: 254.45456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(C(C1)[NH+]2CCCCCC2)[NH3+]

Isomeric SMILES

CC(C)(C)[C@H]1CC[C@@H]([C@H](C1)[NH+]2CCCCCC2)[NH3+]

InChI

InChI=1S/C16H32N2/c1-16(2,3)13-8-9-14(17)15(12-13)18-10-6-4-5-7-11-18/h13-15H,4-12,17H2,1-3H3/p+2/t13-,14-,15-/m0/s1