(4-nitrophenyl)methylsulfonyl benzoate

Systemtic Name: (4-nitrophenyl)methylsulfonyl benzoate Openeye Name: (4-nitrophenyl)methylsulfonyl benzoate CAS Name: benzoic acid (4-nitrophenyl)methylsulfonyl ester IUPAC Name: (4-nitrophenyl)methylsulfonyl benzoate Traditional Name: benzoic acid (4-nitrobenzyl)sulfonyl ester Formula: C14H11NO6S MolecularWeight: 321.30524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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