2,3-dimethoxy-5-(4-oxidanylidene-1-phenyl-4-thiomorpholin-4-yl-butyl)cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2,3-dimethoxy-5-(4-oxidanylidene-1-phenyl-4-thiomorpholin-4-yl-butyl)cyclohexa-2,5-diene-1,4-dione Openeye Name: 2,3-dimethoxy-5-(4-oxo-1-phenyl-4-thiomorpholino-butyl)-1,4-benzoquinone CAS Name: 2,3-dimethoxy-5-(4-oxo-1-phenyl-4-thiomorpholin-4-ylbutyl)cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2,3-dimethoxy-5-(4-oxo-1-phenyl-4-thiomorpholin-4-ylbutyl)cyclohexa-2,5-diene-1,4-dione Traditional Name: 5-(4-keto-1-phenyl-4-thiomorpholino-butyl)-2,3-dimethoxy-p-benzoquinone Formula: C22H25NO5S MolecularWeight: 415.5026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)C(=CC1=O)C(CCC(=O)N2CCSCC2)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C(=O)C(=CC1=O)C(CCC(=O)N2CCSCC2)C3=CC=CC=C3)OC

InChI

InChI=1S/C22H25NO5S/c1-27-21-18(24)14-17(20(26)22(21)28-2)16(15-6-4-3-5-7-15)8-9-19(25)23-10-12-29-13-11-23/h3-7,14,16H,8-13H2,1-2H3