(2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl) 5-bromanyl-2-methoxy-benzenesulfonate

Systemtic Name: (2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl) 5-bromanyl-2-methoxy-benzenesulfonate Openeye Name: (2-oxo-3,4-dihydro-1H-quinolin-6-yl) 5-bromo-2-methoxy-benzenesulfonate CAS Name: 5-bromo-2-methoxybenzenesulfonic acid (2-oxo-3,4-dihydro-1H-quinolin-6-yl) ester IUPAC Name: (2-oxo-3,4-dihydro-1H-quinolin-6-yl) 5-bromo-2-methoxybenzenesulfonate Traditional Name: 5-bromo-2-methoxy-benzenesulfonic acid (2-keto-3,4-dihydro-1H-quinolin-6-yl) ester Formula: C16H14BrNO5S MolecularWeight: 412.25506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)S(=O)(=O)OC2=CC3=C(C=C2)NC(=O)CC3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)S(=O)(=O)OC2=CC3=C(C=C2)NC(=O)CC3

InChI

InChI=1S/C16H14BrNO5S/c1-22-14-6-3-11(17)9-15(14)24(20,21)23-12-4-5-13-10(8-12)2-7-16(19)18-13/h3-6,8-9H,2,7H2,1H3,(H,18,19)