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

Systemtic Name: [(1S,2S)-1-(3,4-dimethylphenyl)-2-methyl-butyl]azanium Openeye Name: [(1S,2S)-1-(3,4-dimethylphenyl)-2-methyl-butyl]ammonium CAS Name: [(1S,2S)-1-(3,4-dimethylphenyl)-2-methylbutyl]ammonium IUPAC Name: [(1S,2S)-1-(3,4-dimethylphenyl)-2-methylbutyl]azanium Traditional Name: [(1S,2S)-1-(3,4-dimethylphenyl)-2-methyl-butyl]ammonium Formula: C13H22N+ MolecularWeight: 192.32048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21N/c1-5-9(2)13(14)12-7-6-10(3)11(4)8-12/h6-9,13H,5,14H2,1-4H3/p+1/t9-,13-/m0/s1