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

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfonyl]-N-pentan-2-yl-piperidine-4-carboxamide Openeye Name: 1-[(2-chloro-6-fluoro-phenyl)methylsulfonyl]-N-(1-methylbutyl)piperidine-4-carboxamide CAS Name: 1-[(2-chloro-6-fluorophenyl)methylsulfonyl]-N-pentan-2-yl-4-piperidinecarboxamide IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methylsulfonyl]-N-pentan-2-ylpiperidine-4-carboxamide Traditional Name: 1-(2-chloro-6-fluoro-benzyl)sulfonyl-N-(1-methylbutyl)isonipecotamide Formula: C18H26ClFN2O3S MolecularWeight: 404.927043

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)C1CCN(CC1)S(=O)(=O)CC2=C(C=CC=C2Cl)F

Isomeric SMILES

CCCC(C)NC(=O)C1CCN(CC1)S(=O)(=O)CC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C18H26ClFN2O3S/c1-3-5-13(2)21-18(23)14-8-10-22(11-9-14)26(24,25)12-15-16(19)6-4-7-17(15)20/h4,6-7,13-14H,3,5,8-12H2,1-2H3,(H,21,23)