2,3-dihexadecylnaphthalene-1-sulfonic acid

Systemtic Name: 2,3-dihexadecylnaphthalene-1-sulfonic acid Openeye Name: 2,3-dihexadecylnaphthalene-1-sulfonic acid CAS Name: 2,3-dihexadecyl-1-naphthalenesulfonic acid IUPAC Name: 2,3-dihexadecylnaphthalene-1-sulfonic acid Traditional Name: 2,3-dicetylnaphthalene-1-sulfonic acid Formula: C42H72O3S MolecularWeight: 657.08428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC1=CC2=CC=CC=C2C(=C1CCCCCCCCCCCCCCCC)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCC1=CC2=CC=CC=C2C(=C1CCCCCCCCCCCCCCCC)S(=O)(=O)O

InChI

InChI=1S/C42H72O3S/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-33-38-37-39-34-31-32-36-41(39)42(46(43,44)45)40(38)35-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h31-32,34,36-37H,3-30,33,35H2,1-2H3,(H,43,44,45)