(5-chloranylquinolin-8-yl) 2-methoxy-5-propan-2-yl-benzenesulfonate

Systemtic Name: (5-chloranylquinolin-8-yl) 2-methoxy-5-propan-2-yl-benzenesulfonate Openeye Name: (5-chloro-8-quinolyl) 5-isopropyl-2-methoxy-benzenesulfonate CAS Name: 2-methoxy-5-propan-2-ylbenzenesulfonic acid (5-chloro-8-quinolinyl) ester IUPAC Name: (5-chloroquinolin-8-yl) 2-methoxy-5-propan-2-ylbenzenesulfonate Traditional Name: 5-isopropyl-2-methoxy-benzenesulfonic acid (5-chloro-8-quinolyl) ester Formula: C19H18ClNO4S MolecularWeight: 391.86852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)OC)S(=O)(=O)OC2=C3C(=C(C=C2)Cl)C=CC=N3

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)OC)S(=O)(=O)OC2=C3C(=C(C=C2)Cl)C=CC=N3

InChI

InChI=1S/C19H18ClNO4S/c1-12(2)13-6-8-16(24-3)18(11-13)26(22,23)25-17-9-7-15(20)14-5-4-10-21-19(14)17/h4-12H,1-3H3