[(1S)-1-(4-ethoxyphenyl)-2-[(2R)-4-methylpentan-2-yl]oxy-ethyl]azanium

Systemtic Name: [(1S)-1-(4-ethoxyphenyl)-2-[(2R)-4-methylpentan-2-yl]oxy-ethyl]azanium Openeye Name: [(1S)-2-[(1R)-1,3-dimethylbutoxy]-1-(4-ethoxyphenyl)ethyl]ammonium CAS Name: [(1S)-1-(4-ethoxyphenyl)-2-[(2R)-4-methylpentan-2-yl]oxyethyl]ammonium IUPAC Name: [(1S)-1-(4-ethoxyphenyl)-2-[(2R)-4-methylpentan-2-yl]oxyethyl]azanium Traditional Name: [(1S)-2-[(1R)-1,3-dimethylbutoxy]-1-p-phenetyl-ethyl]ammonium Formula: C16H28NO2+ MolecularWeight: 266.39902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27NO2/c1-5-18-15-8-6-14(7-9-15)16(17)11-19-13(4)10-12(2)3/h6-9,12-13,16H,5,10-11,17H2,1-4H3/p+1/t13-,16-/m1/s1