(2-methylquinolin-8-yl) 4-chloranylbenzenesulfonate

Systemtic Name: (2-methylquinolin-8-yl) 4-chloranylbenzenesulfonate Openeye Name: (2-methyl-8-quinolyl) 4-chlorobenzenesulfonate CAS Name: 4-chlorobenzenesulfonic acid (2-methyl-8-quinolinyl) ester IUPAC Name: (2-methylquinolin-8-yl) 4-chlorobenzenesulfonate Traditional Name: 4-chlorobenzenesulfonic acid (2-methyl-8-quinolyl) ester Formula: C16H12ClNO3S MolecularWeight: 333.78938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12ClNO3S/c1-11-5-6-12-3-2-4-15(16(12)18-11)21-22(19,20)14-9-7-13(17)8-10-14/h2-10H,1H3