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3-[2,3-di(nonyl)phenoxy]propane-1-sulfonic acid

3-[2,3-di(nonyl)phenoxy]propane-1-sulfonic acid

Systemtic Name:3-[2,3-di(nonyl)phenoxy]propane-1-sulfonic acid
Openeye Name:3-[2,3-di(nonyl)phenoxy]propane-1-sulfonic acid
CAS Name:3-[2,3-di(nonyl)phenoxy]-1-propanesulfonic acid
IUPAC Name:3-[2,3-di(nonyl)phenoxy]propane-1-sulfonic acid
Traditional Name:3-[2,3-di(nonyl)phenoxy]propane-1-sulfonic acid
Formula: C27H48O4S
MolecularWeight: 468.73262
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=C(C(=CC=C1)OCCCS(=O)(=O)O)CCCCCCCCC


Isomeric SMILES

CCCCCCCCCC1=C(C(=CC=C1)OCCCS(=O)(=O)O)CCCCCCCCC


InChI

InChI=1S/C27H48O4S/c1-3-5-7-9-11-13-15-19-25-20-17-22-27(31-23-18-24-32(28,29)30)26(25)21-16-14-12-10-8-6-4-2/h17,20,22H,3-16,18-19,21,23-24H2,1-2H3,(H,28,29,30)


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