N-oxidanyl-2-(phenoxathiin-3-ylsulfonylamino)butanediamide

Systemtic Name: N-oxidanyl-2-(phenoxathiin-3-ylsulfonylamino)butanediamide Openeye Name: 4-(hydroxyamino)-4-oxo-3-(phenoxathiin-3-ylsulfonylamino)butanamide CAS Name: N-hydroxy-2-(3-phenoxathiinylsulfonylamino)butanediamide IUPAC Name: N-hydroxy-2-(phenoxathiin-3-ylsulfonylamino)butanediamide Traditional Name: 4-(hydroxyamino)-4-keto-3-(phenoxathiin-3-ylsulfonylamino)butyramide Formula: C16H15N3O6S2 MolecularWeight: 409.4368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)OC3=C(S2)C=CC(=C3)S(=O)(=O)NC(CC(=O)N)C(=O)NO

Isomeric SMILES

C1=CC=C2C(=C1)OC3=C(S2)C=CC(=C3)S(=O)(=O)NC(CC(=O)N)C(=O)NO

InChI

InChI=1S/C16H15N3O6S2/c17-15(20)8-10(16(21)18-22)19-27(23,24)9-5-6-14-12(7-9)25-11-3-1-2-4-13(11)26-14/h1-7,10,19,22H,8H2,(H2,17,20)(H,18,21)