[(3S,4S)-3-(azocan-1-ium-1-yl)heptan-4-yl]azanium

Systemtic Name: [(3S,4S)-3-(azocan-1-ium-1-yl)heptan-4-yl]azanium Openeye Name: [(1S,2S)-2-(azocan-1-ium-1-yl)-1-propyl-butyl]ammonium CAS Name: [(3S,4S)-3-(1-azocan-1-iumyl)heptan-4-yl]ammonium IUPAC Name: [(3S,4S)-3-(azocan-1-ium-1-yl)heptan-4-yl]azanium Traditional Name: [(1S,2S)-2-(azocan-1-ium-1-yl)-1-propyl-butyl]ammonium Formula: C14H32N2+2 MolecularWeight: 228.41728

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC)[NH+]1CCCCCCC1)[NH3+]

Isomeric SMILES

CCC[C@@H]([C@H](CC)[NH+]1CCCCCCC1)[NH3+]

InChI

InChI=1S/C14H30N2/c1-3-10-13(15)14(4-2)16-11-8-6-5-7-9-12-16/h13-14H,3-12,15H2,1-2H3/p+2/t13-,14-/m0/s1