3,4-didecyl-5-phenoxy-benzene-1,2-disulfonic acid

Systemtic Name: 3,4-didecyl-5-phenoxy-benzene-1,2-disulfonic acid Openeye Name: 3,4-didecyl-5-phenoxy-benzene-1,2-disulfonic acid CAS Name: 3,4-didecyl-5-phenoxybenzene-1,2-disulfonic acid IUPAC Name: 3,4-didecyl-5-phenoxybenzene-1,2-disulfonic acid Traditional Name: 3,4-didecyl-5-phenoxy-benzene-1,2-disulfonic acid Formula: C32H50O7S2 MolecularWeight: 610.8652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=C(C(=C(C=C1OC2=CC=CC=C2)S(=O)(=O)O)S(=O)(=O)O)CCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCC1=C(C(=C(C=C1OC2=CC=CC=C2)S(=O)(=O)O)S(=O)(=O)O)CCCCCCCCCC

InChI

InChI=1S/C32H50O7S2/c1-3-5-7-9-11-13-15-20-24-28-29(25-21-16-14-12-10-8-6-4-2)32(41(36,37)38)31(40(33,34)35)26-30(28)39-27-22-18-17-19-23-27/h17-19,22-23,26H,3-16,20-21,24-25H2,1-2H3,(H,33,34,35)(H,36,37,38)