[(3S,4S)-3-[(2S)-2-methylmorpholin-4-yl]heptan-4-yl]azanium

Systemtic Name: [(3S,4S)-3-[(2S)-2-methylmorpholin-4-yl]heptan-4-yl]azanium Openeye Name: [(1S,2S)-2-[(2S)-2-methylmorpholin-4-yl]-1-propyl-butyl]ammonium CAS Name: [(3S,4S)-3-[(2S)-2-methyl-4-morpholinyl]heptan-4-yl]ammonium IUPAC Name: [(3S,4S)-3-[(2S)-2-methylmorpholin-4-yl]heptan-4-yl]azanium Traditional Name: [(1S,2S)-2-[(2S)-2-methylmorpholino]-1-propyl-butyl]ammonium Formula: C12H27N2O+ MolecularWeight: 215.35558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC)N1CCOC(C1)C)[NH3+]

Isomeric SMILES

CCC[C@@H]([C@H](CC)N1CCO[C@H](C1)C)[NH3+]

InChI

InChI=1S/C12H26N2O/c1-4-6-11(13)12(5-2)14-7-8-15-10(3)9-14/h10-12H,4-9,13H2,1-3H3/p+1/t10-,11-,12-/m0/s1