sodium 1,3-dibutylnaphthalene-2-sulfonate

Systemtic Name: sodium 1,3-dibutylnaphthalene-2-sulfonate Openeye Name: sodium 1,3-dibutylnaphthalene-2-sulfonate CAS Name: sodium 1,3-dibutyl-2-naphthalenesulfonate IUPAC Name: sodium 1,3-dibutylnaphthalene-2-sulfonate Traditional Name: sodium 1,3-dibutylnaphthalene-2-sulfonate Formula: C18H23NaO3S MolecularWeight: 342.42819

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=CC=CC=C2C(=C1S(=O)(=O)[O-])CCCC.[Na+]

Isomeric SMILES

CCCCC1=CC2=CC=CC=C2C(=C1S(=O)(=O)[O-])CCCC.[Na+]

InChI

InChI=1S/C18H24O3S.Na/c1-3-5-9-15-13-14-10-7-8-12-16(14)17(11-6-4-2)18(15)22(19,20)21;/h7-8,10,12-13H,3-6,9,11H2,1-2H3,(H,19,20,21);/q;+1/p-1