propyl 9-oxidanylidene-5,7-disulfamoyl-xanthene-2-carboxylate

Systemtic Name: propyl 9-oxidanylidene-5,7-disulfamoyl-xanthene-2-carboxylate Openeye Name: propyl 9-oxo-5,7-disulfamoyl-xanthene-2-carboxylate CAS Name: 9-oxo-5,7-disulfamoyl-2-xanthenecarboxylic acid propyl ester IUPAC Name: propyl 9-oxo-5,7-disulfamoylxanthene-2-carboxylate Traditional Name: 9-keto-5,7-disulfamoyl-xanthene-2-carboxylic acid propyl ester Formula: C17H16N2O8S2 MolecularWeight: 440.44754

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC2=C(C=C1)OC3=C(C=C(C=C3C2=O)S(=O)(=O)N)S(=O)(=O)N

Isomeric SMILES

CCCOC(=O)C1=CC2=C(C=C1)OC3=C(C=C(C=C3C2=O)S(=O)(=O)N)S(=O)(=O)N

InChI

InChI=1S/C17H16N2O8S2/c1-2-5-26-17(21)9-3-4-13-11(6-9)15(20)12-7-10(28(18,22)23)8-14(16(12)27-13)29(19,24)25/h3-4,6-8H,2,5H2,1H3,(H2,18,22,23)(H2,19,24,25)