N-(4-bromanyl-2-fluoranyl-phenyl)-1-(phenylsulfonyl)piperidine-2-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-1-(phenylsulfonyl)piperidine-2-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-(4-bromo-2-fluoro-phenyl)piperidine-2-carboxamide CAS Name: 1-(benzenesulfonyl)-N-(4-bromo-2-fluorophenyl)-2-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-(4-bromo-2-fluorophenyl)piperidine-2-carboxamide Traditional Name: 1-besyl-N-(4-bromo-2-fluoro-phenyl)pipecolinamide Formula: C18H18BrFN2O3S MolecularWeight: 441.314523

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)NC2=C(C=C(C=C2)Br)F)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCN(C(C1)C(=O)NC2=C(C=C(C=C2)Br)F)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H18BrFN2O3S/c19-13-9-10-16(15(20)12-13)21-18(23)17-8-4-5-11-22(17)26(24,25)14-6-2-1-3-7-14/h1-3,6-7,9-10,12,17H,4-5,8,11H2,(H,21,23)