[(1S)-1-(2-ethoxyphenyl)-2-[(1S,3R)-3-methylcyclohexyl]oxy-ethyl]azanium

Systemtic Name: [(1S)-1-(2-ethoxyphenyl)-2-[(1S,3R)-3-methylcyclohexyl]oxy-ethyl]azanium Openeye Name: [(1S)-1-(2-ethoxyphenyl)-2-[(1S,3R)-3-methylcyclohexoxy]ethyl]ammonium CAS Name: [(1S)-1-(2-ethoxyphenyl)-2-[(1S,3R)-3-methylcyclohexyl]oxyethyl]ammonium IUPAC Name: [(1S)-1-(2-ethoxyphenyl)-2-[(1S,3R)-3-methylcyclohexyl]oxyethyl]azanium Traditional Name: [(1S)-2-[(1S,3R)-3-methylcyclohexoxy]-1-o-phenetyl-ethyl]ammonium Formula: C17H28NO2+ MolecularWeight: 278.40972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(COC2CCCC(C2)C)[NH3+]

Isomeric SMILES

CCOC1=CC=CC=C1[C@@H](CO[C@H]2CCC[C@H](C2)C)[NH3+]

InChI

InChI=1S/C17H27NO2/c1-3-19-17-10-5-4-9-15(17)16(18)12-20-14-8-6-7-13(2)11-14/h4-5,9-10,13-14,16H,3,6-8,11-12,18H2,1-2H3/p+1/t13-,14+,16-/m1/s1