1,4-dioxane; N-(2-ethoxyphenyl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide

Systemtic Name: 1,4-dioxane; N-(2-ethoxyphenyl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide Openeye Name: 1,4-dioxane; N-(2-ethoxyphenyl)-9,10,10-trioxo-thioxanthene-3-carboxamide CAS Name: 1,4-dioxane; N-(2-ethoxyphenyl)-9,10,10-trioxo-3-thioxanthenecarboxamide IUPAC Name: 1,4-dioxane; N-(2-ethoxyphenyl)-9,10,10-trioxothioxanthene-3-carboxamide Traditional Name: 1,4-dioxane; 9,10,10-triketo-N-o-phenetyl-thioxanthene-3-carboxamide Formula: C26H25NO7S MolecularWeight: 495.5442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O.C1COCCO1

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O.C1COCCO1

InChI

InChI=1S/C22H17NO5S.C4H8O2/c1-2-28-18-9-5-4-8-17(18)23-22(25)14-11-12-16-20(13-14)29(26,27)19-10-6-3-7-15(19)21(16)24;1-2-6-4-3-5-1/h3-13H,2H2,1H3,(H,23,25);1-4H2