2,3,4-trioctylnaphthalene-1-sulfonate

Systemtic Name: 2,3,4-trioctylnaphthalene-1-sulfonate Openeye Name: 2,3,4-trioctylnaphthalene-1-sulfonate CAS Name: 2,3,4-trioctyl-1-naphthalenesulfonate IUPAC Name: 2,3,4-trioctylnaphthalene-1-sulfonate Traditional Name: 2,3,4-trioctylnaphthalene-1-sulfonate Formula: C34H55O3S- MolecularWeight: 543.8637

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C(=C(C2=CC=CC=C21)S(=O)(=O)[O-])CCCCCCCC)CCCCCCCC

Isomeric SMILES

CCCCCCCCC1=C(C(=C(C2=CC=CC=C21)S(=O)(=O)[O-])CCCCCCCC)CCCCCCCC

InChI

InChI=1S/C34H56O3S/c1-4-7-10-13-16-19-24-29-30(25-20-17-14-11-8-5-2)32(27-21-18-15-12-9-6-3)34(38(35,36)37)33-28-23-22-26-31(29)33/h22-23,26,28H,4-21,24-25,27H2,1-3H3,(H,35,36,37)/p-1