dimethyl 2,4,6-tris(iodanyl)-5-(2-prop-2-enoxyethanoylamino)benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 2,4,6-tris(iodanyl)-5-(2-prop-2-enoxyethanoylamino)benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(2-allyloxyacetyl)amino]-2,4,6-triiodo-benzene-1,3-dicarboxylate CAS Name: 2,4,6-triiodo-5-[(1-oxo-2-prop-2-enoxyethyl)amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2,4,6-triiodo-5-[(2-prop-2-enoxyacetyl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(2-allyloxyacetyl)amino]-2,4,6-triiodo-benzene-1,3-dicarboxylic acid dimethyl ester Formula: C15H14I3NO6 MolecularWeight: 684.98817

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=C(C(=C1I)NC(=O)COCC=C)I)C(=O)OC)I

Isomeric SMILES

COC(=O)C1=C(C(=C(C(=C1I)NC(=O)COCC=C)I)C(=O)OC)I

InChI

InChI=1S/C15H14I3NO6/c1-4-5-25-6-7(20)19-13-11(17)8(14(21)23-2)10(16)9(12(13)18)15(22)24-3/h4H,1,5-6H2,2-3H3,(H,19,20)