2-(4-aminophenyl)-2-sulfo-ethanethioic S-acid

Systemtic Name: 2-(4-aminophenyl)-2-sulfo-ethanethioic S-acid Openeye Name: 2-(4-aminophenyl)-2-sulfo-ethanethioic S-acid CAS Name: 2-(4-aminophenyl)-2-sulfoethanethioic S-acid IUPAC Name: 2-(4-aminophenyl)-2-sulfoethanethioic S-acid Traditional Name: 2-(4-aminophenyl)-2-sulfo-thioacetic acid Formula: C8H9NO4S2 MolecularWeight: 247.29136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C(=O)S)S(=O)(=O)O)N

Isomeric SMILES

C1=CC(=CC=C1C(C(=O)S)S(=O)(=O)O)N

InChI

InChI=1S/C8H9NO4S2/c9-6-3-1-5(2-4-6)7(8(10)14)15(11,12)13/h1-4,7H,9H2,(H,10,14)(H,11,12,13)