(3-bromanyl-6-fluoranyl-2-oxidanylidene-chromen-4-yl) 4-methylbenzenesulfonate

Systemtic Name: (3-bromanyl-6-fluoranyl-2-oxidanylidene-chromen-4-yl) 4-methylbenzenesulfonate Openeye Name: (3-bromo-6-fluoro-2-oxo-chromen-4-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (3-bromo-6-fluoro-2-oxo-1-benzopyran-4-yl) ester IUPAC Name: (3-bromo-6-fluoro-2-oxochromen-4-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (3-bromo-6-fluoro-2-keto-chromen-4-yl) ester Formula: C16H10BrFO5S MolecularWeight: 413.215003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C(=O)OC3=C2C=C(C=C3)F)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C(=O)OC3=C2C=C(C=C3)F)Br

InChI

InChI=1S/C16H10BrFO5S/c1-9-2-5-11(6-3-9)24(20,21)23-15-12-8-10(18)4-7-13(12)22-16(19)14(15)17/h2-8H,1H3