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

Systemtic Name: [2-iodanyl-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-4-prop-2-enoxy-phenyl] methanesulfonate Openeye Name: [4-allyloxy-3-[2-(tert-butoxycarbonylamino)ethyl]-2-iodo-phenyl] methanesulfonate CAS Name: methanesulfonic acid [2-iodo-3-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethyl]-4-prop-2-enoxyphenyl] ester IUPAC Name: [2-iodo-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-4-prop-2-enoxyphenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-allyloxy-3-[2-(tert-butoxycarbonylamino)ethyl]-2-iodo-phenyl] ester Formula: C17H24INO6S MolecularWeight: 497.34503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC1=C(C=CC(=C1I)OS(=O)(=O)C)OCC=C

Isomeric SMILES

CC(C)(C)OC(=O)NCCC1=C(C=CC(=C1I)OS(=O)(=O)C)OCC=C

InChI

InChI=1S/C17H24INO6S/c1-6-11-23-13-7-8-14(25-26(5,21)22)15(18)12(13)9-10-19-16(20)24-17(2,3)4/h6-8H,1,9-11H2,2-5H3,(H,19,20)