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4-[12-[12-(4-sulfophenyl)dodecoxy]dodecyl]benzenesulfonic acid

4-[12-[12-(4-sulfophenyl)dodecoxy]dodecyl]benzenesulfonic acid

Systemtic Name:4-[12-[12-(4-sulfophenyl)dodecoxy]dodecyl]benzenesulfonic acid
Openeye Name:4-[12-[12-(4-sulfophenyl)dodecoxy]dodecyl]benzenesulfonic acid
CAS Name:4-[12-[12-(4-sulfophenyl)dodecoxy]dodecyl]benzenesulfonic acid
IUPAC Name:4-[12-[12-(4-sulfophenyl)dodecoxy]dodecyl]benzenesulfonic acid
Traditional Name:4-[12-[12-(4-sulfophenyl)dodecoxy]dodecyl]besylic acid
Formula: C36H58O7S2
MolecularWeight: 666.97152
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCCCCCCCCCCOCCCCCCCCCCCCC2=CC=C(C=C2)S(=O)(=O)O)S(=O)(=O)O


Isomeric SMILES

C1=CC(=CC=C1CCCCCCCCCCCCOCCCCCCCCCCCCC2=CC=C(C=C2)S(=O)(=O)O)S(=O)(=O)O


InChI

InChI=1S/C36H58O7S2/c37-44(38,39)35-27-23-33(24-28-35)21-17-13-9-5-1-3-7-11-15-19-31-43-32-20-16-12-8-4-2-6-10-14-18-22-34-25-29-36(30-26-34)45(40,41)42/h23-30H,1-22,31-32H2,(H,37,38,39)(H,40,41,42)


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