2-(4-oxidanylcyclohexyl)-7-(8-oxidanyl-3-oxidanylidene-4H-quinoxalin-2-yl)-1,2-benzothiazol-3-one

Systemtic Name: 2-(4-oxidanylcyclohexyl)-7-(8-oxidanyl-3-oxidanylidene-4H-quinoxalin-2-yl)-1,2-benzothiazol-3-one Openeye Name: 2-(4-hydroxycyclohexyl)-7-(8-hydroxy-3-oxo-4H-quinoxalin-2-yl)-1,2-benzothiazol-3-one CAS Name: 2-(4-hydroxycyclohexyl)-7-(8-hydroxy-3-oxo-4H-quinoxalin-2-yl)-1,2-benzothiazol-3-one IUPAC Name: 2-(4-hydroxycyclohexyl)-7-(8-hydroxy-3-oxo-4H-quinoxalin-2-yl)-1,2-benzothiazol-3-one Traditional Name: 2-(4-hydroxycyclohexyl)-7-(8-hydroxy-3-keto-4H-quinoxalin-2-yl)-1,2-benzothiazol-3-one Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N2C(=O)C3=C(S2)C(=CC=C3)C4=NC5=C(C=CC=C5O)NC4=O)O

Isomeric SMILES

C1CC(CCC1N2C(=O)C3=C(S2)C(=CC=C3)C4=NC5=C(C=CC=C5O)NC4=O)O

InChI

InChI=1S/C21H19N3O4S/c25-12-9-7-11(8-10-12)24-21(28)14-4-1-3-13(19(14)29-24)17-20(27)22-15-5-2-6-16(26)18(15)23-17/h1-6,11-12,25-26H,7-10H2,(H,22,27)