1-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfonyl]-N-(2,6-diethylphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfonyl]-N-(2,6-diethylphenyl)piperidine-4-carboxamide Openeye Name: 1-[(2-chloro-6-fluoro-phenyl)methylsulfonyl]-N-(2,6-diethylphenyl)piperidine-4-carboxamide CAS Name: 1-[(2-chloro-6-fluorophenyl)methylsulfonyl]-N-(2,6-diethylphenyl)-4-piperidinecarboxamide IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methylsulfonyl]-N-(2,6-diethylphenyl)piperidine-4-carboxamide Traditional Name: 1-(2-chloro-6-fluoro-benzyl)sulfonyl-N-(2,6-diethylphenyl)isonipecotamide Formula: C23H28ClFN2O3S MolecularWeight: 466.996423

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C23H28ClFN2O3S/c1-3-16-7-5-8-17(4-2)22(16)26-23(28)18-11-13-27(14-12-18)31(29,30)15-19-20(24)9-6-10-21(19)25/h5-10,18H,3-4,11-15H2,1-2H3,(H,26,28)