dipotassium 3-(4-methylphenyl)sulfonyl-2,5-bis(oxidanyl)benzene-1,4-disulfonate

Systemtic Name: dipotassium 3-(4-methylphenyl)sulfonyl-2,5-bis(oxidanyl)benzene-1,4-disulfonate Openeye Name: dipotassium 2,5-dihydroxy-3-(p-tolylsulfonyl)benzene-1,4-disulfonate CAS Name: dipotassium 2,5-dihydroxy-3-(4-methylphenyl)sulfonylbenzene-1,4-disulfonate IUPAC Name: dipotassium 2,5-dihydroxy-3-(4-methylphenyl)sulfonylbenzene-1,4-disulfonate Traditional Name: dipotassium 2,5-dihydroxy-3-tosyl-benzene-1,4-disulfonate Formula: C13H10K2O10S3 MolecularWeight: 500.6041

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C(=CC(=C2O)S(=O)(=O)[O-])O)S(=O)(=O)[O-].[K+].[K+]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C(=CC(=C2O)S(=O)(=O)[O-])O)S(=O)(=O)[O-].[K+].[K+]

InChI

InChI=1S/C13H12O10S3.2K/c1-7-2-4-8(5-3-7)24(16,17)13-11(15)10(25(18,19)20)6-9(14)12(13)26(21,22)23;;/h2-6,14-15H,1H3,(H,18,19,20)(H,21,22,23);;/q;2*+1/p-2