[(3S,5S)-3-(azaniumylmethyl)-5-methyl-heptan-3-yl]-butyl-methyl-azanium

Systemtic Name: [(3S,5S)-3-(azaniumylmethyl)-5-methyl-heptan-3-yl]-butyl-methyl-azanium Openeye Name: [(1S,3S)-1-(azaniumylmethyl)-1-ethyl-3-methyl-pentyl]-butyl-methyl-ammonium CAS Name: [(3S,5S)-3-(ammoniomethyl)-5-methylheptan-3-yl]-butyl-methylammonium IUPAC Name: [(3S,5S)-3-(azaniumylmethyl)-5-methylheptan-3-yl]-butyl-methylazanium Traditional Name: [(1S,3S)-1-(ammoniomethyl)-1-ethyl-3-methyl-pentyl]-butyl-methyl-ammonium Formula: C14H34N2+2 MolecularWeight: 230.43316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)C(CC)(CC(C)CC)C[NH3+]

Isomeric SMILES

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

InChI

InChI=1S/C14H32N2/c1-6-9-10-16(5)14(8-3,12-15)11-13(4)7-2/h13H,6-12,15H2,1-5H3/p+2/t13-,14-/m0/s1