2-(4-nitrophenyl)-2-sulfo-ethanoic acid

Systemtic Name: 2-(4-nitrophenyl)-2-sulfo-ethanoic acid Openeye Name: 2-(4-nitrophenyl)-2-sulfo-acetic acid CAS Name: 2-(4-nitrophenyl)-2-sulfoacetic acid IUPAC Name: 2-(4-nitrophenyl)-2-sulfoacetic acid Traditional Name: 2-(4-nitrophenyl)-2-sulfo-acetic acid Formula: C8H7NO7S MolecularWeight: 261.20868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C(=O)O)S(=O)(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(C(=O)O)S(=O)(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C8H7NO7S/c10-8(11)7(17(14,15)16)5-1-3-6(4-2-5)9(12)13/h1-4,7H,(H,10,11)(H,14,15,16)