dimethyl benzene-1,4-dicarboxylate; dimethyl 2-iodanylbenzene-1,3-dicarboxylate

Systemtic Name: dimethyl benzene-1,4-dicarboxylate; dimethyl 2-iodanylbenzene-1,3-dicarboxylate Openeye Name: dimethyl benzene-1,4-dicarboxylate; dimethyl 2-iodobenzene-1,3-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid dimethyl ester; 2-iodobenzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl benzene-1,4-dicarboxylate; dimethyl 2-iodobenzene-1,3-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid dimethyl ester; 2-iodobenzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H19IO8 MolecularWeight: 514.26453

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)OC.COC(=O)C1=C(C(=CC=C1)C(=O)OC)I

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)OC.COC(=O)C1=C(C(=CC=C1)C(=O)OC)I

InChI

InChI=1S/C10H9IO4.C10H10O4/c1-14-9(12)6-4-3-5-7(8(6)11)10(13)15-2;1-13-9(11)7-3-5-8(6-4-7)10(12)14-2/h3-5H,1-2H3;3-6H,1-2H3