tert-butyl N-[2-[3-methyl-1-(triphenylmethyl)imidazol-1-ium-4-yl]ethyl]carbamate iodide

Systemtic Name: tert-butyl N-[2-[3-methyl-1-(triphenylmethyl)imidazol-1-ium-4-yl]ethyl]carbamate iodide Openeye Name: tert-butyl N-[2-(3-methyl-1-trityl-imidazol-1-ium-4-yl)ethyl]carbamate iodide CAS Name: N-[2-[3-methyl-1-(triphenylmethyl)-4-imidazol-1-iumyl]ethyl]carbamic acid tert-butyl ester iodide IUPAC Name: tert-butyl N-[2-(3-methyl-1-tritylimidazol-1-ium-4-yl)ethyl]carbamate iodide Traditional Name: N-[2-(3-methyl-1-trityl-imidazol-1-ium-4-yl)ethyl]carbamic acid tert-butyl ester iodide Formula: C30H34IN3O2 MolecularWeight: 595.51433

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC1=C[N+](=CN1C)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[I-]

Isomeric SMILES

CC(C)(C)OC(=O)NCCC1=C[N+](=CN1C)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[I-]

InChI

InChI=1S/C30H33N3O2.HI/c1-29(2,3)35-28(34)31-21-20-27-22-33(23-32(27)4)30(24-14-8-5-9-15-24,25-16-10-6-11-17-25)26-18-12-7-13-19-26;/h5-19,22-23H,20-21H2,1-4H3;1H