3-[bis(azanyl)phosphoryl-(4-nitrophenyl)sulfonyl-amino]benzoate

Systemtic Name: 3-[bis(azanyl)phosphoryl-(4-nitrophenyl)sulfonyl-amino]benzoate Openeye Name: 3-[diaminophosphoryl-(4-nitrophenyl)sulfonyl-amino]benzoate CAS Name: 3-[diaminophosphoryl-(4-nitrophenyl)sulfonylamino]benzoate IUPAC Name: 3-[diaminophosphoryl-(4-nitrophenyl)sulfonylamino]benzoate Traditional Name: 3-[diaminophosphoryl(nosyl)amino]benzoate Formula: C13H12N4O7PS- MolecularWeight: 399.295741

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N(P(=O)(N)N)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)N(P(=O)(N)N)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C13H13N4O7PS/c14-25(15,22)17(11-3-1-2-9(8-11)13(18)19)26(23,24)12-6-4-10(5-7-12)16(20)21/h1-8H,(H,18,19)(H4,14,15,22)/p-1