[(2E)-2-[(5-methoxy-1-methyl-indol-3-yl)methylidene]-7-methyl-3-oxidanylidene-1-benzofuran-6-yl] 4-fluoranylbenzenesulfonate

Systemtic Name: [(2E)-2-[(5-methoxy-1-methyl-indol-3-yl)methylidene]-7-methyl-3-oxidanylidene-1-benzofuran-6-yl] 4-fluoranylbenzenesulfonate Openeye Name: [(2E)-2-[(5-methoxy-1-methyl-indol-3-yl)methylene]-7-methyl-3-oxo-benzofuran-6-yl] 4-fluorobenzenesulfonate CAS Name: 4-fluorobenzenesulfonic acid [(2E)-2-[(5-methoxy-1-methyl-3-indolyl)methylidene]-7-methyl-3-oxo-6-benzofuranyl] ester IUPAC Name: [(2E)-2-[(5-methoxy-1-methylindol-3-yl)methylidene]-7-methyl-3-oxo-1-benzofuran-6-yl] 4-fluorobenzenesulfonate Traditional Name: 4-fluorobenzenesulfonic acid [(2E)-3-keto-2-[(5-methoxy-1-methyl-indol-3-yl)methylene]-7-methyl-coumaran-6-yl] ester Formula: C26H20FNO6S MolecularWeight: 493.503503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=CC3=CN(C4=C3C=C(C=C4)OC)C)C2=O)OS(=O)(=O)C5=CC=C(C=C5)F

Isomeric SMILES

CC1=C(C=CC2=C1O/C(=C/C3=CN(C4=C3C=C(C=C4)OC)C)/C2=O)OS(=O)(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C26H20FNO6S/c1-15-23(34-35(30,31)19-7-4-17(27)5-8-19)11-9-20-25(29)24(33-26(15)20)12-16-14-28(2)22-10-6-18(32-3)13-21(16)22/h4-14H,1-3H3/b24-12+