(7-methoxy-4-methyl-2-oxidanylidene-chromen-6-yl) 4-methylbenzenesulfonate

Systemtic Name: (7-methoxy-4-methyl-2-oxidanylidene-chromen-6-yl) 4-methylbenzenesulfonate Openeye Name: (7-methoxy-4-methyl-2-oxo-chromen-6-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (7-methoxy-4-methyl-2-oxo-1-benzopyran-6-yl) ester IUPAC Name: (7-methoxy-4-methyl-2-oxochromen-6-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-keto-7-methoxy-4-methyl-chromen-6-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=C(C=C3C(=C2)C(=CC(=O)O3)C)OC

Isomeric SMILES

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

InChI

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