ethyl 1-[4-chloranyl-3-[(4-fluorophenyl)sulfonylamino]phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[4-chloranyl-3-[(4-fluorophenyl)sulfonylamino]phenyl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[4-chloro-3-[(4-fluorophenyl)sulfonylamino]benzoyl]piperidine-4-carboxylate CAS Name: 1-[[4-chloro-3-[(4-fluorophenyl)sulfonylamino]phenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-chloro-3-[(4-fluorophenyl)sulfonylamino]benzoyl]piperidine-4-carboxylate Traditional Name: 1-[4-chloro-3-[(4-fluorophenyl)sulfonylamino]benzoyl]isonipecotic acid ethyl ester Formula: C21H22ClFN2O5S MolecularWeight: 468.926183

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=C(C=C2)Cl)NS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=C(C=C2)Cl)NS(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H22ClFN2O5S/c1-2-30-21(27)14-9-11-25(12-10-14)20(26)15-3-8-18(22)19(13-15)24-31(28,29)17-6-4-16(23)5-7-17/h3-8,13-14,24H,2,9-12H2,1H3