(3S)-3-[[(2S)-4-methylpentan-2-yl]oxymethyl]piperidin-1-ium

Systemtic Name: (3S)-3-[[(2S)-4-methylpentan-2-yl]oxymethyl]piperidin-1-ium Openeye Name: (3S)-3-[[(1S)-1,3-dimethylbutoxy]methyl]piperidin-1-ium CAS Name: (3S)-3-[[(2S)-4-methylpentan-2-yl]oxymethyl]piperidin-1-ium IUPAC Name: (3S)-3-[[(2S)-4-methylpentan-2-yl]oxymethyl]piperidin-1-ium Traditional Name: (3S)-3-[[(1S)-1,3-dimethylbutoxy]methyl]piperidin-1-ium Formula: C12H26NO+ MolecularWeight: 200.34094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)OCC1CCC[NH2+]C1

Isomeric SMILES

C[C@@H](CC(C)C)OC[C@H]1CCC[NH2+]C1

InChI

InChI=1S/C12H25NO/c1-10(2)7-11(3)14-9-12-5-4-6-13-8-12/h10-13H,4-9H2,1-3H3/p+1/t11-,12-/m0/s1