2-(4-fluorophenyl)-6-pyrrolidin-1-ylsulfonyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(4-fluorophenyl)-6-pyrrolidin-1-ylsulfonyl-quinoline-4-carboxylic acid Openeye Name: 2-(4-fluorophenyl)-6-pyrrolidin-1-ylsulfonyl-quinoline-4-carboxylic acid CAS Name: 2-(4-fluorophenyl)-6-(1-pyrrolidinylsulfonyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(4-fluorophenyl)-6-pyrrolidin-1-ylsulfonylquinoline-4-carboxylic acid Traditional Name: 2-(4-fluorophenyl)-6-pyrrolidinosulfonyl-cinchoninic acid Formula: C20H17FN2O4S MolecularWeight: 400.423383

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3C(=O)O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3C(=O)O)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H17FN2O4S/c21-14-5-3-13(4-6-14)19-12-17(20(24)25)16-11-15(7-8-18(16)22-19)28(26,27)23-9-1-2-10-23/h3-8,11-12H,1-2,9-10H2,(H,24,25)