tert-butyl N-[3-[4-[[(E)-3-iodanylprop-2-enoxy]carbonylamino]phenoxy]-2-oxidanyl-propyl]-N-propan-2-yl-carbamate

Systemtic Name: tert-butyl N-[3-[4-[[(E)-3-iodanylprop-2-enoxy]carbonylamino]phenoxy]-2-oxidanyl-propyl]-N-propan-2-yl-carbamate Openeye Name: tert-butyl N-[2-hydroxy-3-[4-[[(E)-3-iodoallyloxy]carbonylamino]phenoxy]propyl]-N-isopropyl-carbamate CAS Name: N-[2-hydroxy-3-[4-[[[(E)-3-iodoprop-2-enoxy]-oxomethyl]amino]phenoxy]propyl]-N-propan-2-ylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-hydroxy-3-[4-[[(E)-3-iodoprop-2-enoxy]carbonylamino]phenoxy]propyl]-N-propan-2-ylcarbamate Traditional Name: N-[2-hydroxy-3-[4-[[(E)-3-iodoallyloxy]carbonylamino]phenoxy]propyl]-N-isopropyl-carbamic acid tert-butyl ester Formula: C21H31IN2O6 MolecularWeight: 534.38511

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC(COC1=CC=C(C=C1)NC(=O)OCC=CI)O)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)N(CC(COC1=CC=C(C=C1)NC(=O)OC/C=C/I)O)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H31IN2O6/c1-15(2)24(20(27)30-21(3,4)5)13-17(25)14-29-18-9-7-16(8-10-18)23-19(26)28-12-6-11-22/h6-11,15,17,25H,12-14H2,1-5H3,(H,23,26)/b11-6+