[(1S)-1-[4-[(2S)-butan-2-yl]phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[4-[(2S)-butan-2-yl]phenyl]ethyl]azanium Openeye Name: [(1S)-1-[4-[(1S)-1-methylpropyl]phenyl]ethyl]ammonium CAS Name: [(1S)-1-[4-[(2S)-butan-2-yl]phenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[4-[(2S)-butan-2-yl]phenyl]ethyl]azanium Traditional Name: [(1S)-1-[4-[(1S)-1-methylpropyl]phenyl]ethyl]ammonium Formula: C12H20N+ MolecularWeight: 178.2939

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19N/c1-4-9(2)11-5-7-12(8-6-11)10(3)13/h5-10H,4,13H2,1-3H3/p+1/t9-,10-/m0/s1