disodium 2-sulfanylcarbonylphenolate

Systemtic Name: disodium 2-sulfanylcarbonylphenolate Openeye Name: disodium 2-sulfanylcarbonylphenolate CAS Name: disodium 2-[mercapto(oxo)methyl]phenolate IUPAC Name: disodium 2-sulfanylcarbonylphenolate Traditional Name: disodium 2-thiocarboxyphenolate Formula: C14H10Na2O4S2 MolecularWeight: 352.33634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C7H6O2S.2Na/c2*8-6-4-2-1-3-5(6)7(9)10;;/h2*1-4,8H,(H,9,10);;/q;;2*+1/p-2