3-(3-bromanyl-5-trimethylstannyl-phenyl)imidazol-3-ium-1-amine; 2,3,4-tri(propan-2-yl)benzenesulfonate

Systemtic Name: 3-(3-bromanyl-5-trimethylstannyl-phenyl)imidazol-3-ium-1-amine; 2,3,4-tri(propan-2-yl)benzenesulfonate Openeye Name: 3-(3-bromo-5-trimethylstannyl-phenyl)imidazol-3-ium-1-amine; 2,3,4-triisopropylbenzenesulfonate CAS Name: 3-(3-bromo-5-trimethylstannylphenyl)-1-imidazol-3-iumamine; 2,3,4-tri(propan-2-yl)benzenesulfonate IUPAC Name: 3-(3-bromo-5-trimethylstannylphenyl)imidazol-3-ium-1-amine; 2,3,4-tri(propan-2-yl)benzenesulfonate Traditional Name: [3-(3-bromo-5-trimethylstannyl-phenyl)imidazol-3-ium-1-yl]amine; 2,3,4-triisopropylbesylate Formula: C27H40BrN3O3SSn MolecularWeight: 685.3038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=C(C=C1)S(=O)(=O)[O-])C(C)C)C(C)C.C[Sn](C)(C)C1=CC(=CC(=C1)Br)[N+]2=CN(C=C2)N

Isomeric SMILES

CC(C)C1=C(C(=C(C=C1)S(=O)(=O)[O-])C(C)C)C(C)C.C[Sn](C)(C)C1=CC(=CC(=C1)Br)[N+]2=CN(C=C2)N

InChI

InChI=1S/C15H24O3S.C9H8BrN3.3CH3.Sn/c1-9(2)12-7-8-13(19(16,17)18)15(11(5)6)14(12)10(3)4;10-8-2-1-3-9(6-8)12-4-5-13(11)7-12;;;;/h7-11H,1-6H3,(H,16,17,18);2-7H,11H2;3*1H3;/q;+1;;;;/p-1