N-(4-nitro-2-phenoxy-phenyl)methanesulfonamide phosphate

Systemtic Name: N-(4-nitro-2-phenoxy-phenyl)methanesulfonamide phosphate Openeye Name: N-(4-nitro-2-phenoxy-phenyl)methanesulfonamide phosphate CAS Name: N-(4-nitro-2-phenoxyphenyl)methanesulfonamide phosphate IUPAC Name: N-(4-nitro-2-phenoxyphenyl)methanesulfonamide phosphate Traditional Name: N-(4-nitro-2-phenoxy-phenyl)methanesulfonamide phosphate Formula: C13H12N2O9PS-3 MolecularWeight: 403.281141

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])OC2=CC=CC=C2.[O-]P(=O)([O-])[O-]

Isomeric SMILES

CS(=O)(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])OC2=CC=CC=C2.[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C13H12N2O5S.H3O4P/c1-21(18,19)14-12-8-7-10(15(16)17)9-13(12)20-11-5-3-2-4-6-11;1-5(2,3)4/h2-9,14H,1H3;(H3,1,2,3,4)/p-3