ethyl 4-[[1-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperidin-4-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[1-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperidin-4-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[1-(3-chloro-4-fluoro-phenyl)sulfonylpiperidine-4-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[1-(3-chloro-4-fluorophenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[1-(3-chloro-4-fluorophenyl)sulfonylpiperidine-4-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[1-(3-chloro-4-fluoro-phenyl)sulfonylisonipecotoyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C20H27ClFN3O5S MolecularWeight: 475.961883

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C20H27ClFN3O5S/c1-2-30-20(27)24-9-7-15(8-10-24)23-19(26)14-5-11-25(12-6-14)31(28,29)16-3-4-18(22)17(21)13-16/h3-4,13-15H,2,5-12H2,1H3,(H,23,26)