[2-(dimethylamino)-2-methyl-propyl]-[(2S)-heptan-2-yl]azanium

Systemtic Name: [2-(dimethylamino)-2-methyl-propyl]-[(2S)-heptan-2-yl]azanium Openeye Name: [2-(dimethylamino)-2-methyl-propyl]-[(1S)-1-methylhexyl]ammonium CAS Name: [2-(dimethylamino)-2-methylpropyl]-[(2S)-heptan-2-yl]ammonium IUPAC Name: [2-(dimethylamino)-2-methylpropyl]-[(2S)-heptan-2-yl]azanium Traditional Name: [2-(dimethylamino)-2-methyl-propyl]-[(1S)-1-methylhexyl]ammonium Formula: C13H31N2+ MolecularWeight: 215.39864

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)[NH2+]CC(C)(C)N(C)C

Isomeric SMILES

CCCCC[C@H](C)[NH2+]CC(C)(C)N(C)C

InChI

InChI=1S/C13H30N2/c1-7-8-9-10-12(2)14-11-13(3,4)15(5)6/h12,14H,7-11H2,1-6H3/p+1/t12-/m0/s1