(7-chloranylquinolin-4-yl) 4-methylbenzenesulfonate

Systemtic Name: (7-chloranylquinolin-4-yl) 4-methylbenzenesulfonate Openeye Name: (7-chloro-4-quinolyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (7-chloro-4-quinolinyl) ester IUPAC Name: (7-chloroquinolin-4-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (7-chloro-4-quinolyl) ester Formula: C16H12ClNO3S MolecularWeight: 333.78938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C3C=CC(=CC3=NC=C2)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C3C=CC(=CC3=NC=C2)Cl

InChI

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