[(1R)-1-(2-ethoxyphenyl)-2-[(2S)-octan-2-yl]oxy-ethyl]azanium

Systemtic Name: [(1R)-1-(2-ethoxyphenyl)-2-[(2S)-octan-2-yl]oxy-ethyl]azanium Openeye Name: [(1R)-1-(2-ethoxyphenyl)-2-[(1S)-1-methylheptoxy]ethyl]ammonium CAS Name: [(1R)-1-(2-ethoxyphenyl)-2-[(2S)-octan-2-yl]oxyethyl]ammonium IUPAC Name: [(1R)-1-(2-ethoxyphenyl)-2-[(2S)-octan-2-yl]oxyethyl]azanium Traditional Name: [(1R)-2-[(1S)-1-methylheptoxy]-1-o-phenetyl-ethyl]ammonium Formula: C18H32NO2+ MolecularWeight: 294.45218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OCC(C1=CC=CC=C1OCC)[NH3+]

Isomeric SMILES

CCCCCC[C@H](C)OC[C@@H](C1=CC=CC=C1OCC)[NH3+]

InChI

InChI=1S/C18H31NO2/c1-4-6-7-8-11-15(3)21-14-17(19)16-12-9-10-13-18(16)20-5-2/h9-10,12-13,15,17H,4-8,11,14,19H2,1-3H3/p+1/t15-,17-/m0/s1