disodium 3-(2-dodecylphenoxy)benzene-1,2-disulfonate

Systemtic Name: disodium 3-(2-dodecylphenoxy)benzene-1,2-disulfonate Openeye Name: disodium 3-(2-dodecylphenoxy)benzene-1,2-disulfonate CAS Name: disodium 3-(2-dodecylphenoxy)benzene-1,2-disulfonate IUPAC Name: disodium 3-(2-dodecylphenoxy)benzene-1,2-disulfonate Traditional Name: disodium 3-(2-laurylphenoxy)benzene-1,2-disulfonate Formula: C24H32Na2O7S2 MolecularWeight: 542.61622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1OC2=C(C(=CC=C2)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1OC2=C(C(=CC=C2)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C24H34O7S2.2Na/c1-2-3-4-5-6-7-8-9-10-11-15-20-16-12-13-17-21(20)31-22-18-14-19-23(32(25,26)27)24(22)33(28,29)30;;/h12-14,16-19H,2-11,15H2,1H3,(H,25,26,27)(H,28,29,30);;/q;2*+1/p-2