2-[2,5-bis(chloranyl)thiophen-3-yl]-6-piperidin-1-ylsulfonyl-quinoline-4-carboxylic acid

Systemtic Name: 2-[2,5-bis(chloranyl)thiophen-3-yl]-6-piperidin-1-ylsulfonyl-quinoline-4-carboxylic acid Openeye Name: 2-(2,5-dichloro-3-thienyl)-6-(1-piperidylsulfonyl)quinoline-4-carboxylic acid CAS Name: 2-(2,5-dichloro-3-thiophenyl)-6-(1-piperidinylsulfonyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(2,5-dichlorothiophen-3-yl)-6-piperidin-1-ylsulfonylquinoline-4-carboxylic acid Traditional Name: 2-(2,5-dichloro-3-thienyl)-6-piperidinosulfonyl-cinchoninic acid Formula: C19H16Cl2N2O4S2 MolecularWeight: 471.37734

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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=C(SC(=C4)Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C19H16Cl2N2O4S2/c20-17-10-14(18(21)28-17)16-9-13(19(24)25)12-8-11(4-5-15(12)22-16)29(26,27)23-6-2-1-3-7-23/h4-5,8-10H,1-3,6-7H2,(H,24,25)