(5-methoxy-2-methyl-4-oxidanylidene-chromen-7-yl) 4-methylbenzenesulfonate

Systemtic Name: (5-methoxy-2-methyl-4-oxidanylidene-chromen-7-yl) 4-methylbenzenesulfonate Openeye Name: (5-methoxy-2-methyl-4-oxo-chromen-7-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (5-methoxy-2-methyl-4-oxo-1-benzopyran-7-yl) ester IUPAC Name: (5-methoxy-2-methyl-4-oxochromen-7-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (4-keto-5-methoxy-2-methyl-chromen-7-yl) ester Formula: C18H16O6S MolecularWeight: 360.38104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=C3C(=C2)OC(=CC3=O)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=C3C(=C2)OC(=CC3=O)C)OC

InChI

InChI=1S/C18H16O6S/c1-11-4-6-14(7-5-11)25(20,21)24-13-9-16(22-3)18-15(19)8-12(2)23-17(18)10-13/h4-10H,1-3H3