disodium 6-methyl-5-oxidanyl-7-sulfinatooxy-naphthalene-2-sulfonate

Systemtic Name: disodium 6-methyl-5-oxidanyl-7-sulfinatooxy-naphthalene-2-sulfonate Openeye Name: disodium 5-hydroxy-6-methyl-7-sulfinatooxy-naphthalene-2-sulfonate CAS Name: disodium 5-hydroxy-6-methyl-7-sulfinatooxy-2-naphthalenesulfonate IUPAC Name: disodium 5-hydroxy-6-methyl-7-sulfinatooxynaphthalene-2-sulfonate Traditional Name: disodium 5-hydroxy-6-methyl-7-sulfito-naphthalene-2-sulfonate Formula: C11H8Na2O7S2 MolecularWeight: 362.28656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=C(C=CC2=C1O)S(=O)(=O)[O-])OS(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CC1=C(C=C2C=C(C=CC2=C1O)S(=O)(=O)[O-])OS(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C11H10O7S2.2Na/c1-6-10(18-19(13)14)5-7-4-8(20(15,16)17)2-3-9(7)11(6)12;;/h2-5,12H,1H3,(H,13,14)(H,15,16,17);;/q;2*+1/p-2