(2S,3S)-2-(2-methyl-1H-imidazol-3-ium-3-yl)pentan-3-amine

Systemtic Name: (2S,3S)-2-(2-methyl-1H-imidazol-3-ium-3-yl)pentan-3-amine Openeye Name: (2S,3S)-2-(2-methyl-1H-imidazol-3-ium-3-yl)pentan-3-amine CAS Name: (2S,3S)-2-(2-methyl-1H-imidazol-3-ium-3-yl)-3-pentanamine IUPAC Name: (2S,3S)-2-(2-methyl-1H-imidazol-3-ium-3-yl)pentan-3-amine Traditional Name: [(1S,2S)-1-ethyl-2-(2-methyl-1H-imidazol-3-ium-3-yl)propyl]amine Formula: C9H18N3+ MolecularWeight: 168.25932

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)[N+]1=C(NC=C1)C)N

Isomeric SMILES

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

InChI

InChI=1S/C9H17N3/c1-4-9(10)7(2)12-6-5-11-8(12)3/h5-7,9H,4,10H2,1-3H3/p+1/t7-,9-/m0/s1