[(1S)-1-(2,5-dimethoxyphenyl)-2-[(2S)-4-methylpentan-2-yl]oxy-ethyl]azanium

Systemtic Name: [(1S)-1-(2,5-dimethoxyphenyl)-2-[(2S)-4-methylpentan-2-yl]oxy-ethyl]azanium Openeye Name: [(1S)-1-(2,5-dimethoxyphenyl)-2-[(1S)-1,3-dimethylbutoxy]ethyl]ammonium CAS Name: [(1S)-1-(2,5-dimethoxyphenyl)-2-[(2S)-4-methylpentan-2-yl]oxyethyl]ammonium IUPAC Name: [(1S)-1-(2,5-dimethoxyphenyl)-2-[(2S)-4-methylpentan-2-yl]oxyethyl]azanium Traditional Name: [(1S)-1-(2,5-dimethoxyphenyl)-2-[(1S)-1,3-dimethylbutoxy]ethyl]ammonium Formula: C16H28NO3+ MolecularWeight: 282.39842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)OCC(C1=C(C=CC(=C1)OC)OC)[NH3+]

Isomeric SMILES

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

InChI

InChI=1S/C16H27NO3/c1-11(2)8-12(3)20-10-15(17)14-9-13(18-4)6-7-16(14)19-5/h6-7,9,11-12,15H,8,10,17H2,1-5H3/p+1/t12-,15+/m0/s1