(2,6-dinitrophenyl)methyl phenylmethanesulfonate

Systemtic Name: (2,6-dinitrophenyl)methyl phenylmethanesulfonate Openeye Name: (2,6-dinitrophenyl)methyl phenylmethanesulfonate CAS Name: phenylmethanesulfonic acid (2,6-dinitrophenyl)methyl ester IUPAC Name: (2,6-dinitrophenyl)methyl phenylmethanesulfonate Traditional Name: phenylmethanesulfonic acid (2,6-dinitrobenzyl) ester Formula: C14H12N2O7S MolecularWeight: 352.31928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N2O7S/c17-15(18)13-7-4-8-14(16(19)20)12(13)9-23-24(21,22)10-11-5-2-1-3-6-11/h1-8H,9-10H2