[5,7-bis(iodanyl)quinolin-8-yl] 3,4-dimethylbenzenesulfonate

Systemtic Name: [5,7-bis(iodanyl)quinolin-8-yl] 3,4-dimethylbenzenesulfonate Openeye Name: (5,7-diiodo-8-quinolyl) 3,4-dimethylbenzenesulfonate CAS Name: 3,4-dimethylbenzenesulfonic acid (5,7-diiodo-8-quinolinyl) ester IUPAC Name: (5,7-diiodoquinolin-8-yl) 3,4-dimethylbenzenesulfonate Traditional Name: 3,4-dimethylbenzenesulfonic acid (5,7-diiodo-8-quinolyl) ester Formula: C17H13I2NO3S MolecularWeight: 565.16396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)OC2=C(C=C(C3=C2N=CC=C3)I)I)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)OC2=C(C=C(C3=C2N=CC=C3)I)I)C

InChI

InChI=1S/C17H13I2NO3S/c1-10-5-6-12(8-11(10)2)24(21,22)23-17-15(19)9-14(18)13-4-3-7-20-16(13)17/h3-9H,1-2H3