[(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl]-(pyridin-2-ylmethyl)azanium

Systemtic Name: [(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl]-(pyridin-2-ylmethyl)azanium Openeye Name: [(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexyl]-(2-pyridylmethyl)ammonium CAS Name: [(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]-(2-pyridinylmethyl)ammonium IUPAC Name: [(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]-(pyridin-2-ylmethyl)azanium Traditional Name: [(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexyl]-(2-pyridylmethyl)ammonium Formula: C16H27N2+ MolecularWeight: 247.39898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)[NH2+]CC2=CC=CC=N2)C(C)C

Isomeric SMILES

C[C@H]1CC[C@@H]([C@H](C1)[NH2+]CC2=CC=CC=N2)C(C)C

InChI

InChI=1S/C16H26N2/c1-12(2)15-8-7-13(3)10-16(15)18-11-14-6-4-5-9-17-14/h4-6,9,12-13,15-16,18H,7-8,10-11H2,1-3H3/p+1/t13-,15+,16-/m0/s1