[(1R)-2-azaniumyl-1-(2-methylphenyl)ethyl]-dibutyl-azanium

Systemtic Name: [(1R)-2-azaniumyl-1-(2-methylphenyl)ethyl]-dibutyl-azanium Openeye Name: [(1R)-2-azaniumyl-1-(o-tolyl)ethyl]-dibutyl-ammonium CAS Name: [(1R)-2-ammonio-1-(2-methylphenyl)ethyl]-dibutylammonium IUPAC Name: [(1R)-2-azaniumyl-1-(2-methylphenyl)ethyl]-dibutylazanium Traditional Name: [(1R)-2-ammonio-1-(o-tolyl)ethyl]-dibutyl-ammonium Formula: C17H32N2+2 MolecularWeight: 264.44938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)C(C[NH3+])C1=CC=CC=C1C

Isomeric SMILES

CCCC[NH+](CCCC)[C@@H](C[NH3+])C1=CC=CC=C1C

InChI

InChI=1S/C17H30N2/c1-4-6-12-19(13-7-5-2)17(14-18)16-11-9-8-10-15(16)3/h8-11,17H,4-7,12-14,18H2,1-3H3/p+2/t17-/m0/s1