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

Systemtic Name: 2-(4-chlorophenyl)-6-piperidin-1-ylsulfonyl-quinoline-4-carboxylic acid Openeye Name: 2-(4-chlorophenyl)-6-(1-piperidylsulfonyl)quinoline-4-carboxylic acid CAS Name: 2-(4-chlorophenyl)-6-(1-piperidinylsulfonyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(4-chlorophenyl)-6-piperidin-1-ylsulfonylquinoline-4-carboxylic acid Traditional Name: 2-(4-chlorophenyl)-6-piperidinosulfonyl-cinchoninic acid Formula: C21H19ClN2O4S MolecularWeight: 430.90456

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3C(=O)O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3C(=O)O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H19ClN2O4S/c22-15-6-4-14(5-7-15)20-13-18(21(25)26)17-12-16(8-9-19(17)23-20)29(27,28)24-10-2-1-3-11-24/h4-9,12-13H,1-3,10-11H2,(H,25,26)