[(1S,2S)-1-(3,4-dimethoxyphenyl)-2-methyl-butyl]azanium

Systemtic Name: [(1S,2S)-1-(3,4-dimethoxyphenyl)-2-methyl-butyl]azanium Openeye Name: [(1S,2S)-1-(3,4-dimethoxyphenyl)-2-methyl-butyl]ammonium CAS Name: [(1S,2S)-1-(3,4-dimethoxyphenyl)-2-methylbutyl]ammonium IUPAC Name: [(1S,2S)-1-(3,4-dimethoxyphenyl)-2-methylbutyl]azanium Traditional Name: [(1S,2S)-1-(3,4-dimethoxyphenyl)-2-methyl-butyl]ammonium Formula: C13H22NO2+ MolecularWeight: 224.31928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21NO2/c1-5-9(2)13(14)10-6-7-11(15-3)12(8-10)16-4/h6-9,13H,5,14H2,1-4H3/p+1/t9-,13-/m0/s1