N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-(4-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-(4-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-(4-fluorophenyl)sulfonyl-isonipecotamide Formula: C20H20BrFN2O5S MolecularWeight: 499.350603

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=C(C=C2Br)OCCO3)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=C(C=C2Br)OCCO3)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H20BrFN2O5S/c21-16-11-18-19(29-10-9-28-18)12-17(16)23-20(25)13-5-7-24(8-6-13)30(26,27)15-3-1-14(22)2-4-15/h1-4,11-13H,5-10H2,(H,23,25)