(3S,4S)-3-(1H-imidazol-3-ium-3-yl)heptan-4-amine

Systemtic Name: (3S,4S)-3-(1H-imidazol-3-ium-3-yl)heptan-4-amine Openeye Name: (3S,4S)-3-(1H-imidazol-3-ium-3-yl)heptan-4-amine CAS Name: (3S,4S)-3-(1H-imidazol-3-ium-3-yl)-4-heptanamine IUPAC Name: (3S,4S)-3-(1H-imidazol-3-ium-3-yl)heptan-4-amine Traditional Name: [(1S,2S)-2-(1H-imidazol-3-ium-3-yl)-1-propyl-butyl]amine Formula: C10H20N3+ MolecularWeight: 182.2859

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC)[N+]1=CNC=C1)N

Isomeric SMILES

CCC[C@@H]([C@H](CC)[N+]1=CNC=C1)N

InChI

InChI=1S/C10H19N3/c1-3-5-9(11)10(4-2)13-7-6-12-8-13/h6-10H,3-5,11H2,1-2H3/p+1/t9-,10-/m0/s1