(2-methylquinolin-4-yl) 4-iodanylbenzenesulfonate

Systemtic Name: (2-methylquinolin-4-yl) 4-iodanylbenzenesulfonate Openeye Name: (2-methyl-4-quinolyl) 4-iodobenzenesulfonate CAS Name: 4-iodobenzenesulfonic acid (2-methyl-4-quinolinyl) ester IUPAC Name: (2-methylquinolin-4-yl) 4-iodobenzenesulfonate Traditional Name: 4-iodobenzenesulfonic acid (2-methyl-4-quinolyl) ester Formula: C16H12INO3S MolecularWeight: 425.24085

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)OS(=O)(=O)C3=CC=C(C=C3)I

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)OS(=O)(=O)C3=CC=C(C=C3)I

InChI

InChI=1S/C16H12INO3S/c1-11-10-16(14-4-2-3-5-15(14)18-11)21-22(19,20)13-8-6-12(17)7-9-13/h2-10H,1H3