2-chloranyl-1-(4-nitrophenyl)-2-oxidanylidene-ethanesulfonic acid

Systemtic Name: 2-chloranyl-1-(4-nitrophenyl)-2-oxidanylidene-ethanesulfonic acid Openeye Name: 2-chloro-1-(4-nitrophenyl)-2-oxo-ethanesulfonic acid CAS Name: 2-chloro-1-(4-nitrophenyl)-2-oxoethanesulfonic acid IUPAC Name: 2-chloro-1-(4-nitrophenyl)-2-oxoethanesulfonic acid Traditional Name: 2-chloro-2-keto-1-(4-nitrophenyl)ethanesulfonic acid Formula: C8H6ClNO6S MolecularWeight: 279.65434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H6ClNO6S/c9-8(11)7(17(14,15)16)5-1-3-6(4-2-5)10(12)13/h1-4,7H,(H,14,15,16)