disodium N,N'-bis(4-oxidanidylsulfonothioylphenyl)hexanediamide

Systemtic Name: disodium N,N'-bis(4-oxidanidylsulfonothioylphenyl)hexanediamide Openeye Name: disodium N,N'-bis(4-oxidosulfonothioylphenyl)hexanediamide CAS Name: disodium N,N'-bis(4-oxidosulfonothioylphenyl)hexanediamide IUPAC Name: disodium N,N'-bis(4-oxidosulfonothioylphenyl)hexanediamide Traditional Name: disodium N,N'-bis(4-oxidosulfonothioylphenyl)adipamide Formula: C18H18N2Na2O6S4 MolecularWeight: 532.58486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CCCCC(=O)NC2=CC=C(C=C2)S(=O)(=S)[O-])S(=O)(=S)[O-].[Na+].[Na+]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CCCCC(=O)NC2=CC=C(C=C2)S(=O)(=S)[O-])S(=O)(=S)[O-].[Na+].[Na+]

InChI

InChI=1S/C18H20N2O6S4.2Na/c21-17(19-13-5-9-15(10-6-13)29(23,24)27)3-1-2-4-18(22)20-14-7-11-16(12-8-14)30(25,26)28;;/h5-12H,1-4H2,(H,19,21)(H,20,22)(H,23,24,27)(H,25,26,28);;/q;2*+1/p-2