[(2S)-5-methylhexan-2-yl]-(3-phenylpropyl)azanium

Systemtic Name: [(2S)-5-methylhexan-2-yl]-(3-phenylpropyl)azanium Openeye Name: [(1S)-1,4-dimethylpentyl]-(3-phenylpropyl)ammonium CAS Name: [(2S)-5-methylhexan-2-yl]-(3-phenylpropyl)ammonium IUPAC Name: [(2S)-5-methylhexan-2-yl]-(3-phenylpropyl)azanium Traditional Name: [(1S)-1,4-dimethylpentyl]-(3-phenylpropyl)ammonium Formula: C16H28N+ MolecularWeight: 234.40022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)[NH2+]CCCC1=CC=CC=C1

Isomeric SMILES

C[C@@H](CCC(C)C)[NH2+]CCCC1=CC=CC=C1

InChI

InChI=1S/C16H27N/c1-14(2)11-12-15(3)17-13-7-10-16-8-5-4-6-9-16/h4-6,8-9,14-15,17H,7,10-13H2,1-3H3/p+1/t15-/m0/s1