(2-oxidanylidenechromen-4-yl) 4-bromanyl-2-ethyl-benzenesulfonate

Systemtic Name: (2-oxidanylidenechromen-4-yl) 4-bromanyl-2-ethyl-benzenesulfonate Openeye Name: (2-oxochromen-4-yl) 4-bromo-2-ethyl-benzenesulfonate CAS Name: 4-bromo-2-ethylbenzenesulfonic acid (2-oxo-1-benzopyran-4-yl) ester IUPAC Name: (2-oxochromen-4-yl) 4-bromo-2-ethylbenzenesulfonate Traditional Name: 4-bromo-2-ethyl-benzenesulfonic acid (2-ketochromen-4-yl) ester Formula: C17H13BrO5S MolecularWeight: 409.25112

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)S(=O)(=O)OC2=CC(=O)OC3=CC=CC=C32

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)S(=O)(=O)OC2=CC(=O)OC3=CC=CC=C32

InChI

InChI=1S/C17H13BrO5S/c1-2-11-9-12(18)7-8-16(11)24(20,21)23-15-10-17(19)22-14-6-4-3-5-13(14)15/h3-10H,2H2,1H3