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

Systemtic Name: (2S)-2-[2-(2-bromanyl-4-fluoranyl-phenoxy)ethanoylamino]-N-propyl-propanamide Openeye Name: (2S)-2-[[2-(2-bromo-4-fluoro-phenoxy)acetyl]amino]-N-propyl-propanamide CAS Name: (2S)-2-[[2-(2-bromo-4-fluorophenoxy)-1-oxoethyl]amino]-N-propylpropanamide IUPAC Name: (2S)-2-[[2-(2-bromo-4-fluorophenoxy)acetyl]amino]-N-propylpropanamide Traditional Name: (2S)-2-[[2-(2-bromo-4-fluoro-phenoxy)acetyl]amino]-N-propyl-propionamide Formula: C14H18BrFN2O3 MolecularWeight: 361.206723

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18BrFN2O3/c1-3-6-17-14(20)9(2)18-13(19)8-21-12-5-4-10(16)7-11(12)15/h4-5,7,9H,3,6,8H2,1-2H3,(H,17,20)(H,18,19)/t9-/m0/s1