(4-nitrophenyl)methyl hydrogen sulfate

Systemtic Name: (4-nitrophenyl)methyl hydrogen sulfate Openeye Name: (4-nitrophenyl)methyl hydrogen sulfate CAS Name: sulfuric acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl hydrogen sulfate Traditional Name: sulfuric acid (4-nitrobenzyl) ester Formula: C7H7NO6S MolecularWeight: 233.19858

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COS(=O)(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1COS(=O)(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C7H7NO6S/c9-8(10)7-3-1-6(2-4-7)5-14-15(11,12)13/h1-4H,5H2,(H,11,12,13)