(3R)-N-(4-bromanyl-2-fluoranyl-phenyl)-1-ethylsulfonyl-piperidine-3-carboxamide

Systemtic Name: (3R)-N-(4-bromanyl-2-fluoranyl-phenyl)-1-ethylsulfonyl-piperidine-3-carboxamide Openeye Name: (3R)-N-(4-bromo-2-fluoro-phenyl)-1-ethylsulfonyl-piperidine-3-carboxamide CAS Name: (3R)-N-(4-bromo-2-fluorophenyl)-1-ethylsulfonyl-3-piperidinecarboxamide IUPAC Name: (3R)-N-(4-bromo-2-fluorophenyl)-1-ethylsulfonylpiperidine-3-carboxamide Traditional Name: (3R)-N-(4-bromo-2-fluoro-phenyl)-1-esyl-nipecotamide Formula: C14H18BrFN2O3S MolecularWeight: 393.271723

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCCC(C1)C(=O)NC2=C(C=C(C=C2)Br)F

Isomeric SMILES

CCS(=O)(=O)N1CCC[C@H](C1)C(=O)NC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C14H18BrFN2O3S/c1-2-22(20,21)18-7-3-4-10(9-18)14(19)17-13-6-5-11(15)8-12(13)16/h5-6,8,10H,2-4,7,9H2,1H3,(H,17,19)/t10-/m1/s1