(4-acetyloxy-3-nitro-phenyl)methanesulfinic acid

Systemtic Name: (4-acetyloxy-3-nitro-phenyl)methanesulfinic acid Openeye Name: (4-acetoxy-3-nitro-phenyl)methanesulfinic acid CAS Name: (4-acetyloxy-3-nitrophenyl)methanesulfinic acid IUPAC Name: (4-acetyloxy-3-nitrophenyl)methanesulfinic acid Traditional Name: (4-acetoxy-3-nitro-phenyl)methanesulfinic acid Formula: C9H9NO6S MolecularWeight: 259.23586

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)CS(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)CS(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C9H9NO6S/c1-6(11)16-9-3-2-7(5-17(14)15)4-8(9)10(12)13/h2-4H,5H2,1H3,(H,14,15)