sodium 1-(4-nonylphenoxy)butane-1-sulfonic acid

Systemtic Name: sodium 1-(4-nonylphenoxy)butane-1-sulfonic acid Openeye Name: sodium 1-(4-nonylphenoxy)butane-1-sulfonic acid CAS Name: sodium 1-(4-nonylphenoxy)-1-butanesulfonic acid IUPAC Name: sodium 1-(4-nonylphenoxy)butane-1-sulfonic acid Traditional Name: sodium 1-(4-nonylphenoxy)butane-1-sulfonic acid Formula: C19H32NaO4S+ MolecularWeight: 379.50975

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)OC(CCC)S(=O)(=O)O.[Na+]

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)OC(CCC)S(=O)(=O)O.[Na+]

InChI

InChI=1S/C19H32O4S.Na/c1-3-5-6-7-8-9-10-12-17-13-15-18(16-14-17)23-19(11-4-2)24(20,21)22;/h13-16,19H,3-12H2,1-2H3,(H,20,21,22);/q;+1