[(2S)-4-(2,5-dimethoxyphenyl)butan-2-yl]azanium

Systemtic Name: [(2S)-4-(2,5-dimethoxyphenyl)butan-2-yl]azanium Openeye Name: [(1S)-3-(2,5-dimethoxyphenyl)-1-methyl-propyl]ammonium CAS Name: [(2S)-4-(2,5-dimethoxyphenyl)butan-2-yl]ammonium IUPAC Name: [(2S)-4-(2,5-dimethoxyphenyl)butan-2-yl]azanium Traditional Name: [(1S)-3-(2,5-dimethoxyphenyl)-1-methyl-propyl]ammonium Formula: C12H20NO2+ MolecularWeight: 210.2927

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=C(C=CC(=C1)OC)OC)[NH3+]

Isomeric SMILES

C[C@@H](CCC1=C(C=CC(=C1)OC)OC)[NH3+]

InChI

InChI=1S/C12H19NO2/c1-9(13)4-5-10-8-11(14-2)6-7-12(10)15-3/h6-9H,4-5,13H2,1-3H3/p+1/t9-/m0/s1