(2-methylquinolin-8-yl) 2,5-bis(bromanyl)benzenesulfonate

Systemtic Name: (2-methylquinolin-8-yl) 2,5-bis(bromanyl)benzenesulfonate Openeye Name: (2-methyl-8-quinolyl) 2,5-dibromobenzenesulfonate CAS Name: 2,5-dibromobenzenesulfonic acid (2-methyl-8-quinolinyl) ester IUPAC Name: (2-methylquinolin-8-yl) 2,5-dibromobenzenesulfonate Traditional Name: 2,5-dibromobenzenesulfonic acid (2-methyl-8-quinolyl) ester Formula: C16H11Br2NO3S MolecularWeight: 457.13644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OS(=O)(=O)C3=C(C=CC(=C3)Br)Br)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OS(=O)(=O)C3=C(C=CC(=C3)Br)Br)C=C1

InChI

InChI=1S/C16H11Br2NO3S/c1-10-5-6-11-3-2-4-14(16(11)19-10)22-23(20,21)15-9-12(17)7-8-13(15)18/h2-9H,1H3