4-[9,10,10-tris(oxidanylidene)thioxanthen-3-yl]carbonylpiperazin-2-one

Systemtic Name: 4-[9,10,10-tris(oxidanylidene)thioxanthen-3-yl]carbonylpiperazin-2-one Openeye Name: 4-(9,10,10-trioxothioxanthene-3-carbonyl)piperazin-2-one CAS Name: 4-[oxo-(9,10,10-trioxo-3-thioxanthenyl)methyl]-2-piperazinone IUPAC Name: 4-(9,10,10-trioxothioxanthene-3-carbonyl)piperazin-2-one Traditional Name: 4-(9,10,10-triketothioxanthene-3-carbonyl)piperazin-2-one Formula: C18H14N2O5S MolecularWeight: 370.37916

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

C1CN(CC(=O)N1)C(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C18H14N2O5S/c21-16-10-20(8-7-19-16)18(23)11-5-6-13-15(9-11)26(24,25)14-4-2-1-3-12(14)17(13)22/h1-6,9H,7-8,10H2,(H,19,21)