ethyl 1-[4-chloranyl-3-(oxolan-2-ylmethylsulfamoyl)phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[4-chloranyl-3-(oxolan-2-ylmethylsulfamoyl)phenyl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[4-chloro-3-(tetrahydrofuran-2-ylmethylsulfamoyl)benzoyl]piperidine-4-carboxylate CAS Name: 1-[[4-chloro-3-(2-oxolanylmethylsulfamoyl)phenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-chloro-3-(oxolan-2-ylmethylsulfamoyl)benzoyl]piperidine-4-carboxylate Traditional Name: 1-[4-chloro-3-(tetrahydrofurfurylsulfamoyl)benzoyl]isonipecotic acid ethyl ester Formula: C20H27ClN2O6S MolecularWeight: 458.95618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)NCC3CCCO3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)NCC3CCCO3

InChI

InChI=1S/C20H27ClN2O6S/c1-2-28-20(25)14-7-9-23(10-8-14)19(24)15-5-6-17(21)18(12-15)30(26,27)22-13-16-4-3-11-29-16/h5-6,12,14,16,22H,2-4,7-11,13H2,1H3