phenyl (2,6-dinitrophenyl)methanesulfinate

Systemtic Name: phenyl (2,6-dinitrophenyl)methanesulfinate Openeye Name: phenyl (2,6-dinitrophenyl)methanesulfinate CAS Name: (2,6-dinitrophenyl)methanesulfinic acid phenyl ester IUPAC Name: phenyl (2,6-dinitrophenyl)methanesulfinate Traditional Name: (2,6-dinitrophenyl)methanesulfinic acid phenyl ester Formula: C13H10N2O6S MolecularWeight: 322.2933

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OS(=O)CC2=C(C=CC=C2[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OS(=O)CC2=C(C=CC=C2[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H10N2O6S/c16-14(17)12-7-4-8-13(15(18)19)11(12)9-22(20)21-10-5-2-1-3-6-10/h1-8H,9H2