N-[3-[[2-(2-bromanyl-4-fluoranyl-phenoxy)propanoylamino]methyl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[3-[[2-(2-bromanyl-4-fluoranyl-phenoxy)propanoylamino]methyl]phenyl]cyclopropanecarboxamide Openeye Name: N-[3-[[2-(2-bromo-4-fluoro-phenoxy)propanoylamino]methyl]phenyl]cyclopropanecarboxamide CAS Name: N-[3-[[[2-(2-bromo-4-fluorophenoxy)-1-oxopropyl]amino]methyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[3-[[2-(2-bromo-4-fluorophenoxy)propanoylamino]methyl]phenyl]cyclopropanecarboxamide Traditional Name: N-[3-[[2-(2-bromo-4-fluoro-phenoxy)propanoylamino]methyl]phenyl]cyclopropanecarboxamide Formula: C20H20BrFN2O3 MolecularWeight: 435.286803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC(=CC=C1)NC(=O)C2CC2)OC3=C(C=C(C=C3)F)Br

Isomeric SMILES

CC(C(=O)NCC1=CC(=CC=C1)NC(=O)C2CC2)OC3=C(C=C(C=C3)F)Br

InChI

InChI=1S/C20H20BrFN2O3/c1-12(27-18-8-7-15(22)10-17(18)21)19(25)23-11-13-3-2-4-16(9-13)24-20(26)14-5-6-14/h2-4,7-10,12,14H,5-6,11H2,1H3,(H,23,25)(H,24,26)