1-[9,10,10-tris(oxidanylidene)thioxanthen-3-yl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[9,10,10-tris(oxidanylidene)thioxanthen-3-yl]carbonylpiperidine-4-carboxamide Openeye Name: 1-(9,10,10-trioxothioxanthene-3-carbonyl)piperidine-4-carboxamide CAS Name: 1-[oxo-(9,10,10-trioxo-3-thioxanthenyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(9,10,10-trioxothioxanthene-3-carbonyl)piperidine-4-carboxamide Traditional Name: 1-(9,10,10-triketothioxanthene-3-carbonyl)isonipecotamide Formula: C20H18N2O5S MolecularWeight: 398.43232

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

C1CN(CCC1C(=O)N)C(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C20H18N2O5S/c21-19(24)12-7-9-22(10-8-12)20(25)13-5-6-15-17(11-13)28(26,27)16-4-2-1-3-14(16)18(15)23/h1-6,11-12H,7-10H2,(H2,21,24)