(2-oxidanylidene-2-phenylazanylsulfanyl-1-phosphono-ethyl)phosphonic acid

Systemtic Name: (2-oxidanylidene-2-phenylazanylsulfanyl-1-phosphono-ethyl)phosphonic acid Openeye Name: (2-anilinosulfanyl-2-oxo-1-phosphono-ethyl)phosphonic acid CAS Name: [2-(anilinothio)-2-oxo-1-phosphonoethyl]phosphonic acid IUPAC Name: (2-anilinosulfanyl-2-oxo-1-phosphonoethyl)phosphonic acid Traditional Name: [2-(anilinothio)-2-keto-1-phosphono-ethyl]phosphonic acid Formula: C8H11NO7P2S MolecularWeight: 327.187962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NSC(=O)C(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)NSC(=O)C(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C8H11NO7P2S/c10-7(8(17(11,12)13)18(14,15)16)19-9-6-4-2-1-3-5-6/h1-5,8-9H,(H2,11,12,13)(H2,14,15,16)