3-[[(2S)-heptan-2-yl]azaniumyl]propyl-dimethyl-azanium

Systemtic Name: 3-[[(2S)-heptan-2-yl]azaniumyl]propyl-dimethyl-azanium Openeye Name: dimethyl-[3-[[(1S)-1-methylhexyl]ammonio]propyl]ammonium CAS Name: 3-[[(2S)-heptan-2-yl]ammonio]propyl-dimethylammonium IUPAC Name: 3-[[(2S)-heptan-2-yl]azaniumyl]propyl-dimethylazanium Traditional Name: dimethyl-[3-[[(1S)-1-methylhexyl]ammonio]propyl]ammonium Formula: C12H30N2+2 MolecularWeight: 202.38

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)[NH2+]CCC[NH+](C)C

Isomeric SMILES

CCCCC[C@H](C)[NH2+]CCC[NH+](C)C

InChI

InChI=1S/C12H28N2/c1-5-6-7-9-12(2)13-10-8-11-14(3)4/h12-13H,5-11H2,1-4H3/p+2/t12-/m0/s1