(5-chloranylquinolin-8-yl) 1-(4-fluorophenyl)sulfonylpiperidine-3-carboxylate

Systemtic Name: (5-chloranylquinolin-8-yl) 1-(4-fluorophenyl)sulfonylpiperidine-3-carboxylate Openeye Name: (5-chloro-8-quinolyl) 1-(4-fluorophenyl)sulfonylpiperidine-3-carboxylate CAS Name: 1-(4-fluorophenyl)sulfonyl-3-piperidinecarboxylic acid (5-chloro-8-quinolinyl) ester IUPAC Name: (5-chloroquinolin-8-yl) 1-(4-fluorophenyl)sulfonylpiperidine-3-carboxylate Traditional Name: 1-(4-fluorophenyl)sulfonylnipecotic acid (5-chloro-8-quinolyl) ester Formula: C21H18ClFN2O4S MolecularWeight: 448.895023

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)OC3=C4C(=C(C=C3)Cl)C=CC=N4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)OC3=C4C(=C(C=C3)Cl)C=CC=N4

InChI

InChI=1S/C21H18ClFN2O4S/c22-18-9-10-19(20-17(18)4-1-11-24-20)29-21(26)14-3-2-12-25(13-14)30(27,28)16-7-5-15(23)6-8-16/h1,4-11,14H,2-3,12-13H2