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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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