(2-methylquinolin-8-yl) 2,4,5-tris(chloranyl)benzenesulfonate

Systemtic Name: (2-methylquinolin-8-yl) 2,4,5-tris(chloranyl)benzenesulfonate Openeye Name: (2-methyl-8-quinolyl) 2,4,5-trichlorobenzenesulfonate CAS Name: 2,4,5-trichlorobenzenesulfonic acid (2-methyl-8-quinolinyl) ester IUPAC Name: (2-methylquinolin-8-yl) 2,4,5-trichlorobenzenesulfonate Traditional Name: 2,4,5-trichlorobenzenesulfonic acid (2-methyl-8-quinolyl) ester Formula: C16H10Cl3NO3S MolecularWeight: 402.6795

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OS(=O)(=O)C3=CC(=C(C=C3Cl)Cl)Cl)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OS(=O)(=O)C3=CC(=C(C=C3Cl)Cl)Cl)C=C1

InChI

InChI=1S/C16H10Cl3NO3S/c1-9-5-6-10-3-2-4-14(16(10)20-9)23-24(21,22)15-8-12(18)11(17)7-13(15)19/h2-8H,1H3