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disodium 3-phenyl-6-undecyl-benzene-1,2-disulfonate

disodium 3-phenyl-6-undecyl-benzene-1,2-disulfonate

Systemtic Name:disodium 3-phenyl-6-undecyl-benzene-1,2-disulfonate
Openeye Name:disodium 3-phenyl-6-undecyl-benzene-1,2-disulfonate
CAS Name:disodium 3-phenyl-6-undecylbenzene-1,2-disulfonate
IUPAC Name:disodium 3-phenyl-6-undecylbenzene-1,2-disulfonate
Traditional Name:disodium 3-phenyl-6-undecyl-benzene-1,2-disulfonate
Formula: C23H30Na2O6S2
MolecularWeight: 512.59024
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=C(C(=C(C=C1)C2=CC=CC=C2)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]


Isomeric SMILES

CCCCCCCCCCCC1=C(C(=C(C=C1)C2=CC=CC=C2)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]


InChI

InChI=1S/C23H32O6S2.2Na/c1-2-3-4-5-6-7-8-9-11-16-20-17-18-21(19-14-12-10-13-15-19)23(31(27,28)29)22(20)30(24,25)26;;/h10,12-15,17-18H,2-9,11,16H2,1H3,(H,24,25,26)(H,27,28,29);;/q;2*+1/p-2


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