[2-[(4-chlorophenyl)carbonylamino]-2-oxidanylidene-ethyl] 4-fluoranyl-3-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: [2-[(4-chlorophenyl)carbonylamino]-2-oxidanylidene-ethyl] 4-fluoranyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: [2-[(4-chlorobenzoyl)amino]-2-oxo-ethyl] 4-fluoro-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-fluoro-3-(1-piperidinylsulfonyl)benzoic acid [2-[[(4-chlorophenyl)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[(4-chlorobenzoyl)amino]-2-oxoethyl] 4-fluoro-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-fluoro-3-piperidinosulfonyl-benzoic acid [2-[(4-chlorobenzoyl)amino]-2-keto-ethyl] ester Formula: C21H20ClFN2O6S MolecularWeight: 482.909703

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC(=O)NC(=O)C3=CC=C(C=C3)Cl)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC(=O)NC(=O)C3=CC=C(C=C3)Cl)F

InChI

InChI=1S/C21H20ClFN2O6S/c22-16-7-4-14(5-8-16)20(27)24-19(26)13-31-21(28)15-6-9-17(23)18(12-15)32(29,30)25-10-2-1-3-11-25/h4-9,12H,1-3,10-11,13H2,(H,24,26,27)