5-dodecyl-2-(4-dodecyl-2-sulfo-phenoxy)benzenesulfonic acid

Systemtic Name: 5-dodecyl-2-(4-dodecyl-2-sulfo-phenoxy)benzenesulfonic acid Openeye Name: 5-dodecyl-2-(4-dodecyl-2-sulfo-phenoxy)benzenesulfonic acid CAS Name: 5-dodecyl-2-(4-dodecyl-2-sulfophenoxy)benzenesulfonic acid IUPAC Name: 5-dodecyl-2-(4-dodecyl-2-sulfophenoxy)benzenesulfonic acid Traditional Name: 5-lauryl-2-(4-lauryl-2-sulfo-phenoxy)besylic acid Formula: C36H58O7S2 MolecularWeight: 666.97152

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC(=C(C=C1)OC2=C(C=C(C=C2)CCCCCCCCCCCC)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCC1=CC(=C(C=C1)OC2=C(C=C(C=C2)CCCCCCCCCCCC)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C36H58O7S2/c1-3-5-7-9-11-13-15-17-19-21-23-31-25-27-33(35(29-31)44(37,38)39)43-34-28-26-32(30-36(34)45(40,41)42)24-22-20-18-16-14-12-10-8-6-4-2/h25-30H,3-24H2,1-2H3,(H,37,38,39)(H,40,41,42)