2-(3-chlorophenyl)-6-pyrrolidin-1-ylsulfonyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(3-chlorophenyl)-6-pyrrolidin-1-ylsulfonyl-quinoline-4-carboxylic acid Openeye Name: 2-(3-chlorophenyl)-6-pyrrolidin-1-ylsulfonyl-quinoline-4-carboxylic acid CAS Name: 2-(3-chlorophenyl)-6-(1-pyrrolidinylsulfonyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(3-chlorophenyl)-6-pyrrolidin-1-ylsulfonylquinoline-4-carboxylic acid Traditional Name: 2-(3-chlorophenyl)-6-pyrrolidinosulfonyl-cinchoninic acid Formula: C20H17ClN2O4S MolecularWeight: 416.87798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17ClN2O4S/c21-14-5-3-4-13(10-14)19-12-17(20(24)25)16-11-15(6-7-18(16)22-19)28(26,27)23-8-1-2-9-23/h3-7,10-12H,1-2,8-9H2,(H,24,25)