3-methyl-5-nitro-2,6-bis(oxidanyl)benzenesulfonic acid

Systemtic Name: 3-methyl-5-nitro-2,6-bis(oxidanyl)benzenesulfonic acid Openeye Name: 2,6-dihydroxy-3-methyl-5-nitro-benzenesulfonic acid CAS Name: 2,6-dihydroxy-3-methyl-5-nitrobenzenesulfonic acid IUPAC Name: 2,6-dihydroxy-3-methyl-5-nitrobenzenesulfonic acid Traditional Name: 2,6-dihydroxy-3-methyl-5-nitro-besylic acid Formula: C7H7NO7S MolecularWeight: 249.19798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1O)S(=O)(=O)O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1O)S(=O)(=O)O)O)[N+](=O)[O-]

InChI

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