[(1S,2S)-2-methyl-1-[4-(2-methylpropyl)phenyl]pentyl]azanium

Systemtic Name: [(1S,2S)-2-methyl-1-[4-(2-methylpropyl)phenyl]pentyl]azanium Openeye Name: [(1S,2S)-1-(4-isobutylphenyl)-2-methyl-pentyl]ammonium CAS Name: [(1S,2S)-2-methyl-1-[4-(2-methylpropyl)phenyl]pentyl]ammonium IUPAC Name: [(1S,2S)-2-methyl-1-[4-(2-methylpropyl)phenyl]pentyl]azanium Traditional Name: [(1S,2S)-1-(4-isobutylphenyl)-2-methyl-pentyl]ammonium Formula: C16H28N+ MolecularWeight: 234.40022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27N/c1-5-6-13(4)16(17)15-9-7-14(8-10-15)11-12(2)3/h7-10,12-13,16H,5-6,11,17H2,1-4H3/p+1/t13-,16-/m0/s1