4-[2-[2-[2-(3-ethyl-5-methyl-4-nonyl-phenoxy)ethoxy]ethoxy]ethoxy]butane-1-sulfonic acid

Systemtic Name: 4-[2-[2-[2-(3-ethyl-5-methyl-4-nonyl-phenoxy)ethoxy]ethoxy]ethoxy]butane-1-sulfonic acid Openeye Name: 4-[2-[2-[2-(3-ethyl-5-methyl-4-nonyl-phenoxy)ethoxy]ethoxy]ethoxy]butane-1-sulfonic acid CAS Name: 4-[2-[2-[2-(3-ethyl-5-methyl-4-nonylphenoxy)ethoxy]ethoxy]ethoxy]-1-butanesulfonic acid IUPAC Name: 4-[2-[2-[2-(3-ethyl-5-methyl-4-nonylphenoxy)ethoxy]ethoxy]ethoxy]butane-1-sulfonic acid Traditional Name: 4-[2-[2-[2-(3-ethyl-5-methyl-4-nonyl-phenoxy)ethoxy]ethoxy]ethoxy]butane-1-sulfonic acid Formula: C28H50O7S MolecularWeight: 530.7574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=C(C=C(C=C1C)OCCOCCOCCOCCCCS(=O)(=O)O)CC

Isomeric SMILES

CCCCCCCCCC1=C(C=C(C=C1C)OCCOCCOCCOCCCCS(=O)(=O)O)CC

InChI

InChI=1S/C28H50O7S/c1-4-6-7-8-9-10-11-14-28-25(3)23-27(24-26(28)5-2)35-21-20-34-19-18-33-17-16-32-15-12-13-22-36(29,30)31/h23-24H,4-22H2,1-3H3,(H,29,30,31)