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

Systemtic Name: (1S,2S,4R)-4-tert-butyl-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)cyclohexan-1-amine Openeye Name: (1S,2S,4R)-4-tert-butyl-2-(2-isopropyl-1H-imidazol-3-ium-3-yl)cyclohexanamine CAS Name: (1S,2S,4R)-4-tert-butyl-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)-1-cyclohexanamine IUPAC Name: (1S,2S,4R)-4-tert-butyl-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)cyclohexan-1-amine Traditional Name: [(1S,2S,4R)-4-tert-butyl-2-(2-isopropyl-1H-imidazol-3-ium-3-yl)cyclohexyl]amine Formula: C16H30N3+ MolecularWeight: 264.4295

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=[N+](C=CN1)C2CC(CCC2N)C(C)(C)C

Isomeric SMILES

CC(C)C1=[N+](C=CN1)[C@H]2C[C@@H](CC[C@@H]2N)C(C)(C)C

InChI

InChI=1S/C16H29N3/c1-11(2)15-18-8-9-19(15)14-10-12(16(3,4)5)6-7-13(14)17/h8-9,11-14H,6-7,10,17H2,1-5H3/p+1/t12-,13+,14+/m1/s1