5,6-diethyl-2,5-bis(iodanyl)-3,6-diphenyl-cyclohexa-1,3-diene-1,4-dicarboxylic acid

Systemtic Name: 5,6-diethyl-2,5-bis(iodanyl)-3,6-diphenyl-cyclohexa-1,3-diene-1,4-dicarboxylic acid Openeye Name: 5,6-diethyl-2,5-diiodo-3,6-diphenyl-cyclohexa-1,3-diene-1,4-dicarboxylic acid CAS Name: 5,6-diethyl-2,5-diiodo-3,6-diphenylcyclohexa-1,3-diene-1,4-dicarboxylic acid IUPAC Name: 5,6-diethyl-2,5-diiodo-3,6-diphenylcyclohexa-1,3-diene-1,4-dicarboxylic acid Traditional Name: 5,6-diethyl-2,5-diiodo-3,6-diphenyl-cyclohexa-1,3-diene-1,4-dicarboxylic acid Formula: C24H22I2O4 MolecularWeight: 628.23802

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=C(C(=C(C1(CC)I)C(=O)O)C2=CC=CC=C2)I)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CCC1(C(=C(C(=C(C1(CC)I)C(=O)O)C2=CC=CC=C2)I)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C24H22I2O4/c1-3-23(16-13-9-6-10-14-16)19(22(29)30)20(25)17(15-11-7-5-8-12-15)18(21(27)28)24(23,26)4-2/h5-14H,3-4H2,1-2H3,(H,27,28)(H,29,30)