(2-oxidanylidene-4-propyl-chromen-7-yl) 5-bromanyl-2-ethoxy-benzenesulfonate

Systemtic Name: (2-oxidanylidene-4-propyl-chromen-7-yl) 5-bromanyl-2-ethoxy-benzenesulfonate Openeye Name: (2-oxo-4-propyl-chromen-7-yl) 5-bromo-2-ethoxy-benzenesulfonate CAS Name: 5-bromo-2-ethoxybenzenesulfonic acid (2-oxo-4-propyl-1-benzopyran-7-yl) ester IUPAC Name: (2-oxo-4-propylchromen-7-yl) 5-bromo-2-ethoxybenzenesulfonate Traditional Name: 5-bromo-2-ethoxy-benzenesulfonic acid (2-keto-4-propyl-chromen-7-yl) ester Formula: C20H19BrO6S MolecularWeight: 467.33026

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C=CC(=C2)OS(=O)(=O)C3=C(C=CC(=C3)Br)OCC

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C=CC(=C2)OS(=O)(=O)C3=C(C=CC(=C3)Br)OCC

InChI

InChI=1S/C20H19BrO6S/c1-3-5-13-10-20(22)26-18-12-15(7-8-16(13)18)27-28(23,24)19-11-14(21)6-9-17(19)25-4-2/h6-12H,3-5H2,1-2H3