N-[5-[2-(4-bromanylphenoxy)ethanoylamino]-2-fluoranyl-phenyl]-3-morpholin-4-yl-propanamide

Systemtic Name: N-[5-[2-(4-bromanylphenoxy)ethanoylamino]-2-fluoranyl-phenyl]-3-morpholin-4-yl-propanamide Openeye Name: N-[5-[[2-(4-bromophenoxy)acetyl]amino]-2-fluoro-phenyl]-3-morpholino-propanamide CAS Name: N-[5-[[2-(4-bromophenoxy)-1-oxoethyl]amino]-2-fluorophenyl]-3-(4-morpholinyl)propanamide IUPAC Name: N-[5-[[2-(4-bromophenoxy)acetyl]amino]-2-fluorophenyl]-3-morpholin-4-ylpropanamide Traditional Name: N-[5-[[2-(4-bromophenoxy)acetyl]amino]-2-fluoro-phenyl]-3-morpholino-propionamide Formula: C21H23BrFN3O4 MolecularWeight: 480.327423

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCC(=O)NC2=C(C=CC(=C2)NC(=O)COC3=CC=C(C=C3)Br)F

Isomeric SMILES

C1COCCN1CCC(=O)NC2=C(C=CC(=C2)NC(=O)COC3=CC=C(C=C3)Br)F

InChI

InChI=1S/C21H23BrFN3O4/c22-15-1-4-17(5-2-15)30-14-21(28)24-16-3-6-18(23)19(13-16)25-20(27)7-8-26-9-11-29-12-10-26/h1-6,13H,7-12,14H2,(H,24,28)(H,25,27)