2-(2-bromanyl-4-fluoranyl-phenoxy)-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]propanamide

Systemtic Name: 2-(2-bromanyl-4-fluoranyl-phenoxy)-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]propanamide Openeye Name: 2-(2-bromo-4-fluoro-phenoxy)-N-[1-(p-tolylsulfonyl)-4-piperidyl]propanamide CAS Name: 2-(2-bromo-4-fluorophenoxy)-N-[1-(4-methylphenyl)sulfonyl-4-piperidinyl]propanamide IUPAC Name: 2-(2-bromo-4-fluorophenoxy)-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]propanamide Traditional Name: 2-(2-bromo-4-fluoro-phenoxy)-N-(1-tosyl-4-piperidyl)propionamide Formula: C21H24BrFN2O4S MolecularWeight: 499.393663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C(C)OC3=C(C=C(C=C3)F)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C(C)OC3=C(C=C(C=C3)F)Br

InChI

InChI=1S/C21H24BrFN2O4S/c1-14-3-6-18(7-4-14)30(27,28)25-11-9-17(10-12-25)24-21(26)15(2)29-20-8-5-16(23)13-19(20)22/h3-8,13,15,17H,9-12H2,1-2H3,(H,24,26)