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

Systemtic Name: [2-methoxy-4-[(Z)-(6-methoxy-3-oxidanylidene-1-benzofuran-2-ylidene)methyl]phenyl] 4-methylbenzenesulfonate Openeye Name: [2-methoxy-4-[(Z)-(6-methoxy-3-oxo-benzofuran-2-ylidene)methyl]phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-methoxy-4-[(Z)-(6-methoxy-3-oxo-2-benzofuranylidene)methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(Z)-(6-methoxy-3-oxo-1-benzofuran-2-ylidene)methyl]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [4-[(Z)-(3-keto-6-methoxy-coumaran-2-ylidene)methyl]-2-methoxy-phenyl] ester Formula: C24H20O7S MolecularWeight: 452.4764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)C=C3C(=O)C4=C(O3)C=C(C=C4)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)/C=C\3/C(=O)C4=C(O3)C=C(C=C4)OC)OC

InChI

InChI=1S/C24H20O7S/c1-15-4-8-18(9-5-15)32(26,27)31-20-11-6-16(12-22(20)29-3)13-23-24(25)19-10-7-17(28-2)14-21(19)30-23/h4-14H,1-3H3/b23-13-