[4-[(Z)-(6-methoxy-3-oxidanylidene-1-benzofuran-2-ylidene)methyl]phenyl] benzenesulfonate

Systemtic Name: [4-[(Z)-(6-methoxy-3-oxidanylidene-1-benzofuran-2-ylidene)methyl]phenyl] benzenesulfonate Openeye Name: [4-[(Z)-(6-methoxy-3-oxo-benzofuran-2-ylidene)methyl]phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [4-[(Z)-(6-methoxy-3-oxo-2-benzofuranylidene)methyl]phenyl] ester IUPAC Name: [4-[(Z)-(6-methoxy-3-oxo-1-benzofuran-2-ylidene)methyl]phenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [4-[(Z)-(3-keto-6-methoxy-coumaran-2-ylidene)methyl]phenyl] ester Formula: C22H16O6S MolecularWeight: 408.42384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=O)C(=CC3=CC=C(C=C3)OS(=O)(=O)C4=CC=CC=C4)O2

Isomeric SMILES

COC1=CC2=C(C=C1)C(=O)/C(=C/C3=CC=C(C=C3)OS(=O)(=O)C4=CC=CC=C4)/O2

InChI

InChI=1S/C22H16O6S/c1-26-17-11-12-19-20(14-17)27-21(22(19)23)13-15-7-9-16(10-8-15)28-29(24,25)18-5-3-2-4-6-18/h2-14H,1H3/b21-13-