(1S,2S,4S)-4-(2-methylbutan-2-yl)-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)cyclohexan-1-amine

Systemtic Name: (1S,2S,4S)-4-(2-methylbutan-2-yl)-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)cyclohexan-1-amine Openeye Name: (1S,2S,4S)-4-(1,1-dimethylpropyl)-2-(2-isopropyl-1H-imidazol-3-ium-3-yl)cyclohexanamine CAS Name: (1S,2S,4S)-4-(2-methylbutan-2-yl)-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)-1-cyclohexanamine IUPAC Name: (1S,2S,4S)-4-(2-methylbutan-2-yl)-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)cyclohexan-1-amine Traditional Name: [(1S,2S,4S)-4-tert-amyl-2-(2-isopropyl-1H-imidazol-3-ium-3-yl)cyclohexyl]amine Formula: C17H32N3+ MolecularWeight: 278.45608

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC(C(C1)[N+]2=C(NC=C2)C(C)C)N

Isomeric SMILES

CCC(C)(C)[C@H]1CC[C@@H]([C@H](C1)[N+]2=C(NC=C2)C(C)C)N

InChI

InChI=1S/C17H31N3/c1-6-17(4,5)13-7-8-14(18)15(11-13)20-10-9-19-16(20)12(2)3/h9-10,12-15H,6-8,11,18H2,1-5H3/p+1/t13-,14-,15-/m0/s1