(4-nitrophenyl) 2-phenylethanesulfonate

Systemtic Name: (4-nitrophenyl) 2-phenylethanesulfonate Openeye Name: (4-nitrophenyl) 2-phenylethanesulfonate CAS Name: 2-phenylethanesulfonic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 2-phenylethanesulfonate Traditional Name: 2-phenylethanesulfonic acid (4-nitrophenyl) ester Formula: C14H13NO5S MolecularWeight: 307.32172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCS(=O)(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCS(=O)(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

InChI

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