5-ethylsulfonyl-2-methoxy-4-nitro-benzoic acid

Systemtic Name: 5-ethylsulfonyl-2-methoxy-4-nitro-benzoic acid Openeye Name: 5-ethylsulfonyl-2-methoxy-4-nitro-benzoic acid CAS Name: 5-ethylsulfonyl-2-methoxy-4-nitrobenzoic acid IUPAC Name: 5-ethylsulfonyl-2-methoxy-4-nitrobenzoic acid Traditional Name: 5-esyl-2-methoxy-4-nitro-benzoic acid Formula: C10H11NO7S MolecularWeight: 289.26184

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=C(C=C(C(=C1)C(=O)O)OC)[N+](=O)[O-]

Isomeric SMILES

CCS(=O)(=O)C1=C(C=C(C(=C1)C(=O)O)OC)[N+](=O)[O-]

InChI

InChI=1S/C10H11NO7S/c1-3-19(16,17)9-4-6(10(12)13)8(18-2)5-7(9)11(14)15/h4-5H,3H2,1-2H3,(H,12,13)