2-(5-chloranylthiophen-2-yl)-6-piperidin-1-ylsulfonyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(5-chloranylthiophen-2-yl)-6-piperidin-1-ylsulfonyl-quinoline-4-carboxylic acid Openeye Name: 2-(5-chloro-2-thienyl)-6-(1-piperidylsulfonyl)quinoline-4-carboxylic acid CAS Name: 2-(5-chloro-2-thiophenyl)-6-(1-piperidinylsulfonyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(5-chlorothiophen-2-yl)-6-piperidin-1-ylsulfonylquinoline-4-carboxylic acid Traditional Name: 2-(5-chloro-2-thienyl)-6-piperidinosulfonyl-cinchoninic acid Formula: C19H17ClN2O4S2 MolecularWeight: 436.93228

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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(S4)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3C(=O)O)C4=CC=C(S4)Cl

InChI

InChI=1S/C19H17ClN2O4S2/c20-18-7-6-17(27-18)16-11-14(19(23)24)13-10-12(4-5-15(13)21-16)28(25,26)22-8-2-1-3-9-22/h4-7,10-11H,1-3,8-9H2,(H,23,24)