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

Systemtic Name: N-(1-adamantyl)-1-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: N-(1-adamantyl)-1-[(2-chloro-6-fluoro-phenyl)methylsulfonyl]piperidine-4-carboxamide CAS Name: N-(1-adamantyl)-1-[(2-chloro-6-fluorophenyl)methylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(1-adamantyl)-1-[(2-chloro-6-fluorophenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: N-(1-adamantyl)-1-(2-chloro-6-fluoro-benzyl)sulfonyl-isonipecotamide Formula: C23H30ClFN2O3S MolecularWeight: 469.012303

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC23CC4CC(C2)CC(C4)C3)S(=O)(=O)CC5=C(C=CC=C5Cl)F

Isomeric SMILES

C1CN(CCC1C(=O)NC23CC4CC(C2)CC(C4)C3)S(=O)(=O)CC5=C(C=CC=C5Cl)F

InChI

InChI=1S/C23H30ClFN2O3S/c24-20-2-1-3-21(25)19(20)14-31(29,30)27-6-4-18(5-7-27)22(28)26-23-11-15-8-16(12-23)10-17(9-15)13-23/h1-3,15-18H,4-14H2,(H,26,28)