(3,4-dimethyl-2-oxidanylidene-chromen-7-yl) 4-methoxybenzenesulfonate

Systemtic Name: (3,4-dimethyl-2-oxidanylidene-chromen-7-yl) 4-methoxybenzenesulfonate Openeye Name: (3,4-dimethyl-2-oxo-chromen-7-yl) 4-methoxybenzenesulfonate CAS Name: 4-methoxybenzenesulfonic acid (3,4-dimethyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (3,4-dimethyl-2-oxochromen-7-yl) 4-methoxybenzenesulfonate Traditional Name: 4-methoxybenzenesulfonic acid (2-keto-3,4-dimethyl-chromen-7-yl) ester Formula: C18H16O6S MolecularWeight: 360.38104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OS(=O)(=O)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OS(=O)(=O)C3=CC=C(C=C3)OC)C

InChI

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