2-(3,4-dinitrophenyl)sulfonylethanol

Systemtic Name: 2-(3,4-dinitrophenyl)sulfonylethanol Openeye Name: 2-(3,4-dinitrophenyl)sulfonylethanol CAS Name: 2-(3,4-dinitrophenyl)sulfonylethanol IUPAC Name: 2-(3,4-dinitrophenyl)sulfonylethanol Traditional Name: 2-(3,4-dinitrophenyl)sulfonylethanol Formula: C8H8N2O7S MolecularWeight: 276.22332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)CCO)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)CCO)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C8H8N2O7S/c11-3-4-18(16,17)6-1-2-7(9(12)13)8(5-6)10(14)15/h1-2,5,11H,3-4H2