[(2E)-2-[(1-ethyl-5-methoxy-indol-3-yl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl] 4-fluoranylbenzenesulfonate

Systemtic Name: [(2E)-2-[(1-ethyl-5-methoxy-indol-3-yl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl] 4-fluoranylbenzenesulfonate Openeye Name: [(2E)-2-[(1-ethyl-5-methoxy-indol-3-yl)methylene]-3-oxo-benzofuran-6-yl] 4-fluorobenzenesulfonate CAS Name: 4-fluorobenzenesulfonic acid [(2E)-2-[(1-ethyl-5-methoxy-3-indolyl)methylidene]-3-oxo-6-benzofuranyl] ester IUPAC Name: [(2E)-2-[(1-ethyl-5-methoxyindol-3-yl)methylidene]-3-oxo-1-benzofuran-6-yl] 4-fluorobenzenesulfonate Traditional Name: 4-fluorobenzenesulfonic acid [(2E)-2-[(1-ethyl-5-methoxy-indol-3-yl)methylene]-3-keto-coumaran-6-yl] ester Formula: C26H20FNO6S MolecularWeight: 493.503503

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=C1C=CC(=C2)OC)C=C3C(=O)C4=C(O3)C=C(C=C4)OS(=O)(=O)C5=CC=C(C=C5)F

Isomeric SMILES

CCN1C=C(C2=C1C=CC(=C2)OC)/C=C/3\C(=O)C4=C(O3)C=C(C=C4)OS(=O)(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C26H20FNO6S/c1-3-28-15-16(22-13-18(32-2)7-11-23(22)28)12-25-26(29)21-10-6-19(14-24(21)33-25)34-35(30,31)20-8-4-17(27)5-9-20/h4-15H,3H2,1-2H3/b25-12+