methyl 2-[7-(4-bromophenyl)sulfonyloxy-4-methyl-2-oxidanylidene-chromen-3-yl]ethanoate

Systemtic Name: methyl 2-[7-(4-bromophenyl)sulfonyloxy-4-methyl-2-oxidanylidene-chromen-3-yl]ethanoate Openeye Name: methyl 2-[7-(4-bromophenyl)sulfonyloxy-4-methyl-2-oxo-chromen-3-yl]acetate CAS Name: 2-[7-(4-bromophenyl)sulfonyloxy-4-methyl-2-oxo-1-benzopyran-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[7-(4-bromophenyl)sulfonyloxy-4-methyl-2-oxochromen-3-yl]acetate Traditional Name: 2-(7-brosyloxy-2-keto-4-methyl-chromen-3-yl)acetic acid methyl ester Formula: C19H15BrO7S MolecularWeight: 467.2872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OS(=O)(=O)C3=CC=C(C=C3)Br)CC(=O)OC

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OS(=O)(=O)C3=CC=C(C=C3)Br)CC(=O)OC

InChI

InChI=1S/C19H15BrO7S/c1-11-15-8-5-13(27-28(23,24)14-6-3-12(20)4-7-14)9-17(15)26-19(22)16(11)10-18(21)25-2/h3-9H,10H2,1-2H3