N-[5-[2-(4-bromanylphenoxy)ethanoylamino]-2-methoxy-phenyl]-3-fluoranyl-benzamide

Systemtic Name: N-[5-[2-(4-bromanylphenoxy)ethanoylamino]-2-methoxy-phenyl]-3-fluoranyl-benzamide Openeye Name: N-[5-[[2-(4-bromophenoxy)acetyl]amino]-2-methoxy-phenyl]-3-fluoro-benzamide CAS Name: N-[5-[[2-(4-bromophenoxy)-1-oxoethyl]amino]-2-methoxyphenyl]-3-fluorobenzamide IUPAC Name: N-[5-[[2-(4-bromophenoxy)acetyl]amino]-2-methoxyphenyl]-3-fluorobenzamide Traditional Name: N-[5-[[2-(4-bromophenoxy)acetyl]amino]-2-methoxy-phenyl]-3-fluoro-benzamide Formula: C22H18BrFN2O4 MolecularWeight: 473.291723

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)COC2=CC=C(C=C2)Br)NC(=O)C3=CC(=CC=C3)F

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)COC2=CC=C(C=C2)Br)NC(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C22H18BrFN2O4/c1-29-20-10-7-17(25-21(27)13-30-18-8-5-15(23)6-9-18)12-19(20)26-22(28)14-3-2-4-16(24)11-14/h2-12H,13H2,1H3,(H,25,27)(H,26,28)