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

Systemtic Name: [(3S,4S)-3-(benzimidazol-1-yl)heptan-4-yl]azanium Openeye Name: [(1S,2S)-2-(benzimidazol-1-yl)-1-propyl-butyl]ammonium CAS Name: [(3S,4S)-3-(1-benzimidazolyl)heptan-4-yl]ammonium IUPAC Name: [(3S,4S)-3-(benzimidazol-1-yl)heptan-4-yl]azanium Traditional Name: [(1S,2S)-2-(benzimidazol-1-yl)-1-propyl-butyl]ammonium Formula: C14H22N3+ MolecularWeight: 232.34458

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC)N1C=NC2=CC=CC=C21)[NH3+]

Isomeric SMILES

CCC[C@@H]([C@H](CC)N1C=NC2=CC=CC=C21)[NH3+]

InChI

InChI=1S/C14H21N3/c1-3-7-11(15)13(4-2)17-10-16-12-8-5-6-9-14(12)17/h5-6,8-11,13H,3-4,7,15H2,1-2H3/p+1/t11-,13-/m0/s1