[(2S)-4-[(2S)-octan-2-yl]oxybutan-2-yl]azanium

Systemtic Name: [(2S)-4-[(2S)-octan-2-yl]oxybutan-2-yl]azanium Openeye Name: [(1S)-1-methyl-3-[(1S)-1-methylheptoxy]propyl]ammonium CAS Name: [(2S)-4-[(2S)-octan-2-yl]oxybutan-2-yl]ammonium IUPAC Name: [(2S)-4-[(2S)-octan-2-yl]oxybutan-2-yl]azanium Traditional Name: [(1S)-1-methyl-3-[(1S)-1-methylheptoxy]propyl]ammonium Formula: C12H28NO+ MolecularWeight: 202.35682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OCCC(C)[NH3+]

Isomeric SMILES

CCCCCC[C@H](C)OCC[C@H](C)[NH3+]

InChI

InChI=1S/C12H27NO/c1-4-5-6-7-8-12(3)14-10-9-11(2)13/h11-12H,4-10,13H2,1-3H3/p+1/t11-,12-/m0/s1