2-[(4-oxidanyl-3-sulfo-phenyl)amino]ethanoic acid

Systemtic Name: 2-[(4-oxidanyl-3-sulfo-phenyl)amino]ethanoic acid Openeye Name: 2-(4-hydroxy-3-sulfo-anilino)acetic acid CAS Name: 2-(4-hydroxy-3-sulfoanilino)acetic acid IUPAC Name: 2-(4-hydroxy-3-sulfoanilino)acetic acid Traditional Name: 2-(4-hydroxy-3-sulfo-anilino)acetic acid Formula: C8H9NO6S MolecularWeight: 247.22516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NCC(=O)O)S(=O)(=O)O)O

Isomeric SMILES

C1=CC(=C(C=C1NCC(=O)O)S(=O)(=O)O)O

InChI

InChI=1S/C8H9NO6S/c10-6-2-1-5(9-4-8(11)12)3-7(6)16(13,14)15/h1-3,9-10H,4H2,(H,11,12)(H,13,14,15)