2-methoxy-5-nitro-4-oxidanyl-benzenesulfonic acid

Systemtic Name: 2-methoxy-5-nitro-4-oxidanyl-benzenesulfonic acid Openeye Name: 4-hydroxy-2-methoxy-5-nitro-benzenesulfonic acid CAS Name: 4-hydroxy-2-methoxy-5-nitrobenzenesulfonic acid IUPAC Name: 4-hydroxy-2-methoxy-5-nitrobenzenesulfonic acid Traditional Name: 4-hydroxy-2-methoxy-5-nitro-besylic acid Formula: C7H7NO7S MolecularWeight: 249.19798

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)O)[N+](=O)[O-])S(=O)(=O)O

Isomeric SMILES

COC1=C(C=C(C(=C1)O)[N+](=O)[O-])S(=O)(=O)O

InChI

InChI=1S/C7H7NO7S/c1-15-6-3-5(9)4(8(10)11)2-7(6)16(12,13)14/h2-3,9H,1H3,(H,12,13,14)