[3-nitro-4-(phenylcarbonyloxy)phenyl]methanesulfinic acid

Systemtic Name: [3-nitro-4-(phenylcarbonyloxy)phenyl]methanesulfinic acid Openeye Name: (4-benzoyloxy-3-nitro-phenyl)methanesulfinic acid CAS Name: (4-benzoyloxy-3-nitrophenyl)methanesulfinic acid IUPAC Name: (4-benzoyloxy-3-nitrophenyl)methanesulfinic acid Traditional Name: (4-benzoyloxy-3-nitro-phenyl)methanesulfinic acid Formula: C14H11NO6S MolecularWeight: 321.30524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)CS(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)CS(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C14H11NO6S/c16-14(11-4-2-1-3-5-11)21-13-7-6-10(9-22(19)20)8-12(13)15(17)18/h1-8H,9H2,(H,19,20)