phenyl 2-(4-nitrophenyl)ethanesulfonate

Systemtic Name: phenyl 2-(4-nitrophenyl)ethanesulfonate Openeye Name: phenyl 2-(4-nitrophenyl)ethanesulfonate CAS Name: 2-(4-nitrophenyl)ethanesulfonic acid phenyl ester IUPAC Name: phenyl 2-(4-nitrophenyl)ethanesulfonate Traditional Name: 2-(4-nitrophenyl)ethanesulfonic acid phenyl ester Formula: C14H13NO5S MolecularWeight: 307.32172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OS(=O)(=O)CCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OS(=O)(=O)CCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

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