[(1R)-3-methyl-1-phenyl-butyl]-[(2S)-pentan-2-yl]azanium

Systemtic Name: [(1R)-3-methyl-1-phenyl-butyl]-[(2S)-pentan-2-yl]azanium Openeye Name: [(1S)-1-methylbutyl]-[(1R)-3-methyl-1-phenyl-butyl]ammonium CAS Name: [(1R)-3-methyl-1-phenylbutyl]-[(2S)-pentan-2-yl]ammonium IUPAC Name: [(1R)-3-methyl-1-phenylbutyl]-[(2S)-pentan-2-yl]azanium Traditional Name: [(1S)-1-methylbutyl]-[(1R)-3-methyl-1-phenyl-butyl]ammonium Formula: C16H28N+ MolecularWeight: 234.40022

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)[NH2+]C(CC(C)C)C1=CC=CC=C1

Isomeric SMILES

CCC[C@H](C)[NH2+][C@H](CC(C)C)C1=CC=CC=C1

InChI

InChI=1S/C16H27N/c1-5-9-14(4)17-16(12-13(2)3)15-10-7-6-8-11-15/h6-8,10-11,13-14,16-17H,5,9,12H2,1-4H3/p+1/t14-,16+/m0/s1