[(1S,2S,4S)-4-methyl-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)cyclohexyl]azanium

Systemtic Name: [(1S,2S,4S)-4-methyl-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)cyclohexyl]azanium Openeye Name: [(1S,2S,4S)-2-(2-isopropyl-1H-imidazol-3-ium-3-yl)-4-methyl-cyclohexyl]ammonium CAS Name: [(1S,2S,4S)-4-methyl-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)cyclohexyl]ammonium IUPAC Name: [(1S,2S,4S)-4-methyl-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)cyclohexyl]azanium Traditional Name: [(1S,2S,4S)-2-(2-isopropyl-1H-imidazol-3-ium-3-yl)-4-methyl-cyclohexyl]ammonium Formula: C13H25N3+2 MolecularWeight: 223.3577

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)[N+]2=C(NC=C2)C(C)C)[NH3+]

Isomeric SMILES

C[C@H]1CC[C@@H]([C@H](C1)[N+]2=C(NC=C2)C(C)C)[NH3+]

InChI

InChI=1S/C13H23N3/c1-9(2)13-15-6-7-16(13)12-8-10(3)4-5-11(12)14/h6-7,9-12H,4-5,8,14H2,1-3H3/p+2/t10-,11-,12-/m0/s1