[(2S)-4-(2,5-dimethylphenyl)-2-methyl-butyl]azanium

Systemtic Name: [(2S)-4-(2,5-dimethylphenyl)-2-methyl-butyl]azanium Openeye Name: [(2S)-4-(2,5-dimethylphenyl)-2-methyl-butyl]ammonium CAS Name: [(2S)-4-(2,5-dimethylphenyl)-2-methylbutyl]ammonium IUPAC Name: [(2S)-4-(2,5-dimethylphenyl)-2-methylbutyl]azanium Traditional Name: [(2S)-4-(2,5-dimethylphenyl)-2-methyl-butyl]ammonium Formula: C13H22N+ MolecularWeight: 192.32048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CCC(C)C[NH3+]

Isomeric SMILES

CC1=CC(=C(C=C1)C)CC[C@H](C)C[NH3+]

InChI

InChI=1S/C13H21N/c1-10-4-6-12(3)13(8-10)7-5-11(2)9-14/h4,6,8,11H,5,7,9,14H2,1-3H3/p+1/t11-/m0/s1