6-bromanyl-3-[(E)-4-(4-methoxyphenyl)-2-oxidanylidene-but-3-enyl]sulfonyl-chromen-2-one

Systemtic Name: 6-bromanyl-3-[(E)-4-(4-methoxyphenyl)-2-oxidanylidene-but-3-enyl]sulfonyl-chromen-2-one Openeye Name: 6-bromo-3-[(E)-4-(4-methoxyphenyl)-2-oxo-but-3-enyl]sulfonyl-chromen-2-one CAS Name: 6-bromo-3-[(E)-4-(4-methoxyphenyl)-2-oxobut-3-enyl]sulfonyl-1-benzopyran-2-one IUPAC Name: 6-bromo-3-[(E)-4-(4-methoxyphenyl)-2-oxobut-3-enyl]sulfonylchromen-2-one Traditional Name: 6-bromo-3-[(E)-2-keto-4-(4-methoxyphenyl)but-3-enyl]sulfonyl-coumarin Formula: C20H15BrO6S MolecularWeight: 463.2985

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)CS(=O)(=O)C2=CC3=C(C=CC(=C3)Br)OC2=O

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)CS(=O)(=O)C2=CC3=C(C=CC(=C3)Br)OC2=O

InChI

InChI=1S/C20H15BrO6S/c1-26-17-7-3-13(4-8-17)2-6-16(22)12-28(24,25)19-11-14-10-15(21)5-9-18(14)27-20(19)23/h2-11H,12H2,1H3/b6-2+