[(1S)-1-(4-ethoxyphenyl)-2-propan-2-yloxy-ethyl]azanium

Systemtic Name: [(1S)-1-(4-ethoxyphenyl)-2-propan-2-yloxy-ethyl]azanium Openeye Name: [(1S)-1-(4-ethoxyphenyl)-2-isopropoxy-ethyl]ammonium CAS Name: [(1S)-1-(4-ethoxyphenyl)-2-propan-2-yloxyethyl]ammonium IUPAC Name: [(1S)-1-(4-ethoxyphenyl)-2-propan-2-yloxyethyl]azanium Traditional Name: [(1S)-2-isopropoxy-1-p-phenetyl-ethyl]ammonium Formula: C13H22NO2+ MolecularWeight: 224.31928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(COC(C)C)[NH3+]

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@@H](COC(C)C)[NH3+]

InChI

InChI=1S/C13H21NO2/c1-4-15-12-7-5-11(6-8-12)13(14)9-16-10(2)3/h5-8,10,13H,4,9,14H2,1-3H3/p+1/t13-/m1/s1