[2-iodanyl-3-[1-[(2-methylpropan-2-yl)oxycarbonylamino]propan-2-yl]-4-prop-2-enoxy-phenyl] methanesulfonate

Systemtic Name: [2-iodanyl-3-[1-[(2-methylpropan-2-yl)oxycarbonylamino]propan-2-yl]-4-prop-2-enoxy-phenyl] methanesulfonate Openeye Name: [4-allyloxy-3-[2-(tert-butoxycarbonylamino)-1-methyl-ethyl]-2-iodo-phenyl] methanesulfonate CAS Name: methanesulfonic acid [2-iodo-3-[1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propan-2-yl]-4-prop-2-enoxyphenyl] ester IUPAC Name: [2-iodo-3-[1-[(2-methylpropan-2-yl)oxycarbonylamino]propan-2-yl]-4-prop-2-enoxyphenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-allyloxy-3-[2-(tert-butoxycarbonylamino)-1-methyl-ethyl]-2-iodo-phenyl] ester Formula: C18H26INO6S MolecularWeight: 511.37161

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)OC(C)(C)C)C1=C(C=CC(=C1I)OS(=O)(=O)C)OCC=C

Isomeric SMILES

CC(CNC(=O)OC(C)(C)C)C1=C(C=CC(=C1I)OS(=O)(=O)C)OCC=C

InChI

InChI=1S/C18H26INO6S/c1-7-10-24-13-8-9-14(26-27(6,22)23)16(19)15(13)12(2)11-20-17(21)25-18(3,4)5/h7-9,12H,1,10-11H2,2-6H3,(H,20,21)