sodium [(4-nitrophenoxy)-phenoxy-phosphoryl] benzoate

Systemtic Name: sodium [(4-nitrophenoxy)-phenoxy-phosphoryl] benzoate Openeye Name: sodium [(4-nitrophenoxy)-phenoxy-phosphoryl] benzoate CAS Name: sodium benzoic acid [(4-nitrophenoxy)-phenoxyphosphoryl] ester IUPAC Name: sodium [(4-nitrophenoxy)-phenoxyphosphoryl] benzoate Traditional Name: sodium benzoic acid [(4-nitrophenoxy)-phenoxy-phosphoryl] ester Formula: C19H14NNaO7P+ MolecularWeight: 422.280491

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OP(=O)(OC2=CC=CC=C2)OC3=CC=C(C=C3)[N+](=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OP(=O)(OC2=CC=CC=C2)OC3=CC=C(C=C3)[N+](=O)[O-].[Na+]

InChI

InChI=1S/C19H14NO7P.Na/c21-19(15-7-3-1-4-8-15)27-28(24,25-17-9-5-2-6-10-17)26-18-13-11-16(12-14-18)20(22)23;/h1-14H;/q;+1