disodium 8-[(6-sulfonatonaphthalen-1-yl)methyl]naphthalene-2-sulfonate

Systemtic Name: disodium 8-[(6-sulfonatonaphthalen-1-yl)methyl]naphthalene-2-sulfonate Openeye Name: disodium 8-[(6-sulfonato-1-naphthyl)methyl]naphthalene-2-sulfonate CAS Name: disodium 8-[(6-sulfonato-1-naphthalenyl)methyl]-2-naphthalenesulfonate IUPAC Name: disodium 8-[(6-sulfonatonaphthalen-1-yl)methyl]naphthalene-2-sulfonate Traditional Name: disodium 8-[(6-sulfonato-1-naphthyl)methyl]naphthalene-2-sulfonate Formula: C21H14Na2O6S2 MolecularWeight: 472.4418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C(C=C2)S(=O)(=O)[O-])C(=C1)CC3=CC=CC4=C3C=CC(=C4)S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1=CC2=C(C=C(C=C2)S(=O)(=O)[O-])C(=C1)CC3=CC=CC4=C3C=CC(=C4)S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C21H16O6S2.2Na/c22-28(23,24)18-9-10-20-15(4-2-6-17(20)12-18)11-16-5-1-3-14-7-8-19(13-21(14)16)29(25,26)27;;/h1-10,12-13H,11H2,(H,22,23,24)(H,25,26,27);;/q;2*+1/p-2