[2,4-bis(iodanyl)-6-pent-4-enoyl-phenyl] 4-chloranylbenzenesulfonate

Systemtic Name: [2,4-bis(iodanyl)-6-pent-4-enoyl-phenyl] 4-chloranylbenzenesulfonate Openeye Name: (2,4-diiodo-6-pent-4-enoyl-phenyl) 4-chlorobenzenesulfonate CAS Name: 4-chlorobenzenesulfonic acid [2,4-diiodo-6-(1-oxopent-4-enyl)phenyl] ester IUPAC Name: (2,4-diiodo-6-pent-4-enoylphenyl) 4-chlorobenzenesulfonate Traditional Name: 4-chlorobenzenesulfonic acid (2,4-diiodo-6-pent-4-enoyl-phenyl) ester Formula: C17H13ClI2O4S MolecularWeight: 602.60966

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCC(=O)C1=CC(=CC(=C1OS(=O)(=O)C2=CC=C(C=C2)Cl)I)I

Isomeric SMILES

C=CCCC(=O)C1=CC(=CC(=C1OS(=O)(=O)C2=CC=C(C=C2)Cl)I)I

InChI

InChI=1S/C17H13ClI2O4S/c1-2-3-4-16(21)14-9-12(19)10-15(20)17(14)24-25(22,23)13-7-5-11(18)6-8-13/h2,5-10H,1,3-4H2