[5,7-bis(bromanyl)quinolin-8-yl] 2-methylbenzenesulfonate

Systemtic Name: [5,7-bis(bromanyl)quinolin-8-yl] 2-methylbenzenesulfonate Openeye Name: (5,7-dibromo-8-quinolyl) 2-methylbenzenesulfonate CAS Name: 2-methylbenzenesulfonic acid (5,7-dibromo-8-quinolinyl) ester IUPAC Name: (5,7-dibromoquinolin-8-yl) 2-methylbenzenesulfonate Traditional Name: 2-methylbenzenesulfonic acid (5,7-dibromo-8-quinolyl) ester Formula: C16H11Br2NO3S MolecularWeight: 457.13644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)OC2=C(C=C(C3=C2N=CC=C3)Br)Br

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)OC2=C(C=C(C3=C2N=CC=C3)Br)Br

InChI

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