(5-chloranylquinolin-8-yl) 4-ethylbenzenesulfonate

Systemtic Name: (5-chloranylquinolin-8-yl) 4-ethylbenzenesulfonate Openeye Name: (5-chloro-8-quinolyl) 4-ethylbenzenesulfonate CAS Name: 4-ethylbenzenesulfonic acid (5-chloro-8-quinolinyl) ester IUPAC Name: (5-chloroquinolin-8-yl) 4-ethylbenzenesulfonate Traditional Name: 4-ethylbenzenesulfonic acid (5-chloro-8-quinolyl) ester Formula: C17H14ClNO3S MolecularWeight: 347.81596

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)OC2=C3C(=C(C=C2)Cl)C=CC=N3

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)OC2=C3C(=C(C=C2)Cl)C=CC=N3

InChI

InChI=1S/C17H14ClNO3S/c1-2-12-5-7-13(8-6-12)23(20,21)22-16-10-9-15(18)14-4-3-11-19-17(14)16/h3-11H,2H2,1H3