[(2Z)-2-[(2,4-dichlorophenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl] 4-chloranylbenzenesulfonate

Systemtic Name: [(2Z)-2-[(2,4-dichlorophenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl] 4-chloranylbenzenesulfonate Openeye Name: [(2Z)-2-[(2,4-dichlorophenyl)methylene]-3-oxo-benzofuran-6-yl] 4-chlorobenzenesulfonate CAS Name: 4-chlorobenzenesulfonic acid [(2Z)-2-[(2,4-dichlorophenyl)methylidene]-3-oxo-6-benzofuranyl] ester IUPAC Name: [(2Z)-2-[(2,4-dichlorophenyl)methylidene]-3-oxo-1-benzofuran-6-yl] 4-chlorobenzenesulfonate Traditional Name: 4-chlorobenzenesulfonic acid [(2Z)-2-(2,4-dichlorobenzylidene)-3-keto-coumaran-6-yl] ester Formula: C21H11Cl3O5S MolecularWeight: 481.73304

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1S(=O)(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=C(C=C(C=C4)Cl)Cl)O3)Cl

Isomeric SMILES

C1=CC(=CC=C1S(=O)(=O)OC2=CC3=C(C=C2)C(=O)/C(=C/C4=C(C=C(C=C4)Cl)Cl)/O3)Cl

InChI

InChI=1S/C21H11Cl3O5S/c22-13-3-6-16(7-4-13)30(26,27)29-15-5-8-17-19(11-15)28-20(21(17)25)9-12-1-2-14(23)10-18(12)24/h1-11H/b20-9-