[(3S,4S)-3-(3-methylbutoxy)heptan-4-yl]azanium

Systemtic Name: [(3S,4S)-3-(3-methylbutoxy)heptan-4-yl]azanium Openeye Name: [(1S,2S)-2-isopentyloxy-1-propyl-butyl]ammonium CAS Name: [(3S,4S)-3-(3-methylbutoxy)heptan-4-yl]ammonium IUPAC Name: [(3S,4S)-3-(3-methylbutoxy)heptan-4-yl]azanium Traditional Name: [(1S,2S)-2-isoamoxy-1-propyl-butyl]ammonium Formula: C12H28NO+ MolecularWeight: 202.35682

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC)OCCC(C)C)[NH3+]

Isomeric SMILES

CCC[C@@H]([C@H](CC)OCCC(C)C)[NH3+]

InChI

InChI=1S/C12H27NO/c1-5-7-11(13)12(6-2)14-9-8-10(3)4/h10-12H,5-9,13H2,1-4H3/p+1/t11-,12-/m0/s1