quinolin-8-yl 2,4-bis(chloranyl)-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: quinolin-8-yl 2,4-bis(chloranyl)-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: 8-quinolyl 2,4-dichloro-5-(1-piperidylsulfonyl)benzoate CAS Name: 2,4-dichloro-5-(1-piperidinylsulfonyl)benzoic acid 8-quinolinyl ester IUPAC Name: quinolin-8-yl 2,4-dichloro-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2,4-dichloro-5-piperidinosulfonyl-benzoic acid 8-quinolyl ester Formula: C21H18Cl2N2O4S MolecularWeight: 465.34962

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=C(C(=C2)C(=O)OC3=CC=CC4=C3N=CC=C4)Cl)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=C(C(=C2)C(=O)OC3=CC=CC4=C3N=CC=C4)Cl)Cl

InChI

InChI=1S/C21H18Cl2N2O4S/c22-16-13-17(23)19(30(27,28)25-10-2-1-3-11-25)12-15(16)21(26)29-18-8-4-6-14-7-5-9-24-20(14)18/h4-9,12-13H,1-3,10-11H2