[(1S)-1-(3-acetamidophenyl)ethyl]-[(2S,3S)-3-methylpentan-2-yl]azanium

Systemtic Name: [(1S)-1-(3-acetamidophenyl)ethyl]-[(2S,3S)-3-methylpentan-2-yl]azanium Openeye Name: [(1S)-1-(3-acetamidophenyl)ethyl]-[(1S,2S)-1,2-dimethylbutyl]ammonium CAS Name: [(1S)-1-(3-acetamidophenyl)ethyl]-[(2S,3S)-3-methylpentan-2-yl]ammonium IUPAC Name: [(1S)-1-(3-acetamidophenyl)ethyl]-[(2S,3S)-3-methylpentan-2-yl]azanium Traditional Name: [(1S)-1-(3-acetamidophenyl)ethyl]-[(1S,2S)-1,2-dimethylbutyl]ammonium Formula: C16H27N2O+ MolecularWeight: 263.39838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C)[NH2+]C(C)C1=CC(=CC=C1)NC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2O/c1-6-11(2)12(3)17-13(4)15-8-7-9-16(10-15)18-14(5)19/h7-13,17H,6H2,1-5H3,(H,18,19)/p+1/t11-,12-,13-/m0/s1