3-bromanylpropan-1-amine; tert-butyl N-[2-(2-iodanylethoxy)ethyl]carbamate; hydrobromide

Systemtic Name: 3-bromanylpropan-1-amine; tert-butyl N-[2-(2-iodanylethoxy)ethyl]carbamate; hydrobromide Openeye Name: 3-bromopropan-1-amine; tert-butyl N-[2-(2-iodoethoxy)ethyl]carbamate; hydrobromide CAS Name: 3-bromo-1-propanamine; N-[2-(2-iodoethoxy)ethyl]carbamic acid tert-butyl ester; hydrobromide IUPAC Name: 3-bromopropan-1-amine; tert-butyl N-[2-(2-iodoethoxy)ethyl]carbamate; hydrobromide Traditional Name: 3-bromopropylamine; N-[2-(2-iodoethoxy)ethyl]carbamic acid tert-butyl ester; hydrobromide Formula: C12H27Br2IN2O3 MolecularWeight: 534.06685

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCOCCI.C(CN)CBr.Br

Isomeric SMILES

CC(C)(C)OC(=O)NCCOCCI.C(CN)CBr.Br

InChI

InChI=1S/C9H18INO3.C3H8BrN.BrH/c1-9(2,3)14-8(12)11-5-7-13-6-4-10;4-2-1-3-5;/h4-7H2,1-3H3,(H,11,12);1-3,5H2;1H