tert-butyl 4-[(3-methyl-2H-imidazol-1-yl)carbonyl]piperazine-1-carboxylate iodide

Systemtic Name: tert-butyl 4-[(3-methyl-2H-imidazol-1-yl)carbonyl]piperazine-1-carboxylate iodide Openeye Name: tert-butyl 4-(3-methyl-2H-imidazole-1-carbonyl)piperazine-1-carboxylate iodide CAS Name: 4-[(3-methyl-2H-imidazol-1-yl)-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester iodide IUPAC Name: tert-butyl 4-(3-methyl-2H-imidazole-1-carbonyl)piperazine-1-carboxylate iodide Traditional Name: 4-(3-methyl-4-imidazoline-1-carbonyl)piperazine-1-carboxylic acid tert-butyl ester iodide Formula: C14H24IN4O3- MolecularWeight: 423.26983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)N2CN(C=C2)C.[I-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)N2CN(C=C2)C.[I-]

InChI

InChI=1S/C14H24N4O3.HI/c1-14(2,3)21-13(20)17-9-7-16(8-10-17)12(19)18-6-5-15(4)11-18;/h5-6H,7-11H2,1-4H3;1H/p-1