[(1S,2S)-2-[2-[(2S)-butan-2-yl]phenoxy]cyclohexyl]azanium

Systemtic Name: [(1S,2S)-2-[2-[(2S)-butan-2-yl]phenoxy]cyclohexyl]azanium Openeye Name: [(1S,2S)-2-[2-[(1S)-1-methylpropyl]phenoxy]cyclohexyl]ammonium CAS Name: [(1S,2S)-2-[2-[(2S)-butan-2-yl]phenoxy]cyclohexyl]ammonium IUPAC Name: [(1S,2S)-2-[2-[(2S)-butan-2-yl]phenoxy]cyclohexyl]azanium Traditional Name: [(1S,2S)-2-[2-[(1S)-1-methylpropyl]phenoxy]cyclohexyl]ammonium Formula: C16H26NO+ MolecularWeight: 248.38374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OC2CCCCC2[NH3+]

Isomeric SMILES

CC[C@H](C)C1=CC=CC=C1O[C@H]2CCCC[C@@H]2[NH3+]

InChI

InChI=1S/C16H25NO/c1-3-12(2)13-8-4-6-10-15(13)18-16-11-7-5-9-14(16)17/h4,6,8,10,12,14,16H,3,5,7,9,11,17H2,1-2H3/p+1/t12-,14-,16-/m0/s1