[(1S,2S,4R)-2-(2-methylpropoxy)-4-phenyl-cyclohexyl]azanium

Systemtic Name: [(1S,2S,4R)-2-(2-methylpropoxy)-4-phenyl-cyclohexyl]azanium Openeye Name: [(1S,2S,4R)-2-isobutoxy-4-phenyl-cyclohexyl]ammonium CAS Name: [(1S,2S,4R)-2-(2-methylpropoxy)-4-phenylcyclohexyl]ammonium IUPAC Name: [(1S,2S,4R)-2-(2-methylpropoxy)-4-phenylcyclohexyl]azanium Traditional Name: [(1S,2S,4R)-2-isobutoxy-4-phenyl-cyclohexyl]ammonium Formula: C16H26NO+ MolecularWeight: 248.38374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1CC(CCC1[NH3+])C2=CC=CC=C2

Isomeric SMILES

CC(C)CO[C@H]1C[C@@H](CC[C@@H]1[NH3+])C2=CC=CC=C2

InChI

InChI=1S/C16H25NO/c1-12(2)11-18-16-10-14(8-9-15(16)17)13-6-4-3-5-7-13/h3-7,12,14-16H,8-11,17H2,1-2H3/p+1/t14-,15+,16+/m1/s1