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disodium 1,2-di(nonyl)naphthalene sulfate

disodium 1,2-di(nonyl)naphthalene sulfate

Systemtic Name:disodium 1,2-di(nonyl)naphthalene sulfate
Openeye Name:disodium 1,2-di(nonyl)naphthalene sulfate
CAS Name:disodium 1,2-di(nonyl)naphthalene sulfate
IUPAC Name:disodium 1,2-di(nonyl)naphthalene sulfate
Traditional Name:disodium 1,2-di(nonyl)naphthalene sulfate
Formula: C28H44Na2O4S
MolecularWeight: 522.6911
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=C(C2=CC=CC=C2C=C1)CCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+].[Na+]


Isomeric SMILES

CCCCCCCCCC1=C(C2=CC=CC=C2C=C1)CCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+].[Na+]


InChI

InChI=1S/C28H44.2Na.H2O4S/c1-3-5-7-9-11-13-15-19-25-23-24-26-20-17-18-22-28(26)27(25)21-16-14-12-10-8-6-4-2;;;1-5(2,3)4/h17-18,20,22-24H,3-16,19,21H2,1-2H3;;;(H2,1,2,3,4)/q;2*+1;/p-2


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