sodium 1-methyl-4-sulfonatosulfanyl-benzene

Systemtic Name: sodium 1-methyl-4-sulfonatosulfanyl-benzene Openeye Name: sodium 1-methyl-4-sulfonatosulfanyl-benzene CAS Name: sodium 1-methyl-4-(sulfonatothio)benzene IUPAC Name: sodium 1-methyl-4-sulfonatosulfanylbenzene Traditional Name: sodium 1-methyl-4-(sulfonatothio)benzene Formula: C7H7NaO3S2 MolecularWeight: 226.24845

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)SS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C7H8O3S2.Na/c1-6-2-4-7(5-3-6)11-12(8,9)10;/h2-5H,1H3,(H,8,9,10);/q;+1/p-1