(4-nitrophenyl)methyl phenylmethanesulfonate

Systemtic Name: (4-nitrophenyl)methyl phenylmethanesulfonate Openeye Name: (4-nitrophenyl)methyl phenylmethanesulfonate CAS Name: phenylmethanesulfonic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl phenylmethanesulfonate Traditional Name: phenylmethanesulfonic acid (4-nitrobenzyl) ester Formula: C14H13NO5S MolecularWeight: 307.32172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H13NO5S/c16-15(17)14-8-6-12(7-9-14)10-20-21(18,19)11-13-4-2-1-3-5-13/h1-9H,10-11H2