2-iodosyl-5-[(E)-octadec-7-enyl]benzenesulfonic acid

Systemtic Name: 2-iodosyl-5-[(E)-octadec-7-enyl]benzenesulfonic acid Openeye Name: 2-iodosyl-5-[(E)-octadec-7-enyl]benzenesulfonic acid CAS Name: 2-iodosyl-5-[(E)-octadec-7-enyl]benzenesulfonic acid IUPAC Name: 2-iodosyl-5-[(E)-octadec-7-enyl]benzenesulfonic acid Traditional Name: 2-iodosyl-5-[(E)-octadec-7-enyl]besylic acid Formula: C24H39IO4S MolecularWeight: 550.53353

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC=CCCCCCCC1=CC(=C(C=C1)I=O)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCC/C=C/CCCCCCC1=CC(=C(C=C1)I=O)S(=O)(=O)O

InChI

InChI=1S/C24H39IO4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-19-20-23(25-26)24(21-22)30(27,28)29/h11-12,19-21H,2-10,13-18H2,1H3,(H,27,28,29)/b12-11+