2,3,4-tridodecylnaphthalene-1-sulfonic acid

Systemtic Name: 2,3,4-tridodecylnaphthalene-1-sulfonic acid Openeye Name: 2,3,4-tridodecylnaphthalene-1-sulfonic acid CAS Name: 2,3,4-tridodecyl-1-naphthalenesulfonic acid IUPAC Name: 2,3,4-tridodecylnaphthalene-1-sulfonic acid Traditional Name: 2,3,4-trilaurylnaphthalene-1-sulfonic acid Formula: C46H80O3S MolecularWeight: 713.1906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=C(C(=C(C2=CC=CC=C21)S(=O)(=O)O)CCCCCCCCCCCC)CCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCC1=C(C(=C(C2=CC=CC=C21)S(=O)(=O)O)CCCCCCCCCCCC)CCCCCCCCCCCC

InChI

InChI=1S/C46H80O3S/c1-4-7-10-13-16-19-22-25-28-31-36-41-42(37-32-29-26-23-20-17-14-11-8-5-2)44(39-33-30-27-24-21-18-15-12-9-6-3)46(50(47,48)49)45-40-35-34-38-43(41)45/h34-35,38,40H,4-33,36-37,39H2,1-3H3,(H,47,48,49)