4-[(4-methoxycarbonyl-2-methyl-3-phenyl-3H-1,2-oxazol-5-yl)methylsulfinyl]-N1,N3-bis(oxidanyl)benzene-1,3-diamine oxide

Systemtic Name: 4-[(4-methoxycarbonyl-2-methyl-3-phenyl-3H-1,2-oxazol-5-yl)methylsulfinyl]-N1,N3-bis(oxidanyl)benzene-1,3-diamine oxide Openeye Name: N1,N3-dihydroxy-4-[(4-methoxycarbonyl-2-methyl-3-phenyl-3H-isoxazol-5-yl)methylsulfinyl]benzene-1,3-diamine oxide CAS Name: N1,N3-dihydroxy-4-[(4-methoxycarbonyl-2-methyl-3-phenyl-3H-isoxazol-5-yl)methylsulfinyl]benzene-1,3-diamine oxide IUPAC Name: 1-N,3-N-dihydroxy-4-[(4-methoxycarbonyl-2-methyl-3-phenyl-3H-1,2-oxazol-5-yl)methylsulfinyl]benzene-1,3-diamine oxide Traditional Name: 4-[(4-carbomethoxy-2-methyl-3-phenyl-4-isoxazolin-5-yl)methylsulfinyl]-N,N'-dihydroxy-benzene-1,3-diamine oxide Formula: C19H21N3O8S MolecularWeight: 451.45034

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(=C(O1)CS(=O)C2=C(C=C(C=C2)[NH+](O)[O-])[NH+](O)[O-])C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CN1C(C(=C(O1)CS(=O)C2=C(C=C(C=C2)[NH+](O)[O-])[NH+](O)[O-])C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C19H21N3O8S/c1-20-18(12-6-4-3-5-7-12)17(19(23)29-2)15(30-20)11-31(28)16-9-8-13(21(24)25)10-14(16)22(26)27/h3-10,18,21-22,24,26H,11H2,1-2H3