(4-nitrophenyl) (4-nitrophenyl)methanesulfonate

Systemtic Name: (4-nitrophenyl) (4-nitrophenyl)methanesulfonate Openeye Name: (4-nitrophenyl) (4-nitrophenyl)methanesulfonate CAS Name: (4-nitrophenyl)methanesulfonic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) (4-nitrophenyl)methanesulfonate Traditional Name: (4-nitrophenyl)methanesulfonic acid (4-nitrophenyl) ester Formula: C13H10N2O7S MolecularWeight: 338.2927

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CS(=O)(=O)OC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CS(=O)(=O)OC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H10N2O7S/c16-14(17)11-3-1-10(2-4-11)9-23(20,21)22-13-7-5-12(6-8-13)15(18)19/h1-8H,9H2