(4,7-dimethyl-2-oxidanylidene-chromen-6-yl) 4-bromanylbenzenesulfonate

Systemtic Name: (4,7-dimethyl-2-oxidanylidene-chromen-6-yl) 4-bromanylbenzenesulfonate Openeye Name: (4,7-dimethyl-2-oxo-chromen-6-yl) 4-bromobenzenesulfonate CAS Name: 4-bromobenzenesulfonic acid (4,7-dimethyl-2-oxo-1-benzopyran-6-yl) ester IUPAC Name: (4,7-dimethyl-2-oxochromen-6-yl) 4-bromobenzenesulfonate Traditional Name: 4-bromobenzenesulfonic acid (2-keto-4,7-dimethyl-chromen-6-yl) ester Formula: C17H13BrO5S MolecularWeight: 409.25112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=CC(=C(C=C12)OS(=O)(=O)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1=CC(=O)OC2=CC(=C(C=C12)OS(=O)(=O)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C17H13BrO5S/c1-10-8-17(19)22-16-7-11(2)15(9-14(10)16)23-24(20,21)13-5-3-12(18)4-6-13/h3-9H,1-2H3