[(2R)-butan-2-yl]-[(2S)-2-ethylhexyl]azanium

Systemtic Name: [(2R)-butan-2-yl]-[(2S)-2-ethylhexyl]azanium Openeye Name: [(2S)-2-ethylhexyl]-[(1R)-1-methylpropyl]ammonium CAS Name: [(2R)-butan-2-yl]-[(2S)-2-ethylhexyl]ammonium IUPAC Name: [(2R)-butan-2-yl]-[(2S)-2-ethylhexyl]azanium Traditional Name: [(2S)-2-ethylhexyl]-[(1R)-1-methylpropyl]ammonium Formula: C12H28N+ MolecularWeight: 186.35742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C[NH2+]C(C)CC

Isomeric SMILES

CCCC[C@H](CC)C[NH2+][C@H](C)CC

InChI

InChI=1S/C12H27N/c1-5-8-9-12(7-3)10-13-11(4)6-2/h11-13H,5-10H2,1-4H3/p+1/t11-,12+/m1/s1