(2S)-2-[2-(2-bromanyl-4-fluoranyl-phenoxy)ethanoylamino]-N-ethyl-propanamide

Systemtic Name: (2S)-2-[2-(2-bromanyl-4-fluoranyl-phenoxy)ethanoylamino]-N-ethyl-propanamide Openeye Name: (2S)-2-[[2-(2-bromo-4-fluoro-phenoxy)acetyl]amino]-N-ethyl-propanamide CAS Name: (2S)-2-[[2-(2-bromo-4-fluorophenoxy)-1-oxoethyl]amino]-N-ethylpropanamide IUPAC Name: (2S)-2-[[2-(2-bromo-4-fluorophenoxy)acetyl]amino]-N-ethylpropanamide Traditional Name: (2S)-2-[[2-(2-bromo-4-fluoro-phenoxy)acetyl]amino]-N-ethyl-propionamide Formula: C13H16BrFN2O3 MolecularWeight: 347.180143

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)NC(=O)COC1=C(C=C(C=C1)F)Br

Isomeric SMILES

CCNC(=O)[C@H](C)NC(=O)COC1=C(C=C(C=C1)F)Br

InChI

InChI=1S/C13H16BrFN2O3/c1-3-16-13(19)8(2)17-12(18)7-20-11-5-4-9(15)6-10(11)14/h4-6,8H,3,7H2,1-2H3,(H,16,19)(H,17,18)/t8-/m0/s1