N-(1,3-benzodioxol-5-yl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-9,10,10-trioxo-thioxanthene-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-9,10,10-trioxo-3-thioxanthenecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-9,10,10-trioxothioxanthene-3-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-9,10,10-triketo-thioxanthene-3-carboxamide Formula: C21H13NO6S MolecularWeight: 407.39602

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O

InChI

InChI=1S/C21H13NO6S/c23-20-14-3-1-2-4-18(14)29(25,26)19-9-12(5-7-15(19)20)21(24)22-13-6-8-16-17(10-13)28-11-27-16/h1-10H,11H2,(H,22,24)