sodium 4-[(4-nitrophenyl)methoxy]benzenesulfonate

Systemtic Name: sodium 4-[(4-nitrophenyl)methoxy]benzenesulfonate Openeye Name: sodium 4-[(4-nitrophenyl)methoxy]benzenesulfonate CAS Name: sodium 4-[(4-nitrophenyl)methoxy]benzenesulfonate IUPAC Name: sodium 4-[(4-nitrophenyl)methoxy]benzenesulfonate Traditional Name: sodium 4-(4-nitrobenzyl)oxybesylate Formula: C13H10NNaO6S MolecularWeight: 331.27637

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC2=CC=C(C=C2)S(=O)(=O)[O-])[N+](=O)[O-].[Na+]

Isomeric SMILES

C1=CC(=CC=C1COC2=CC=C(C=C2)S(=O)(=O)[O-])[N+](=O)[O-].[Na+]

InChI

InChI=1S/C13H11NO6S.Na/c15-14(16)11-3-1-10(2-4-11)9-20-12-5-7-13(8-6-12)21(17,18)19;/h1-8H,9H2,(H,17,18,19);/q;+1/p-1