methyl (2R)-2-[2-(2-bromanyl-4-fluoranyl-phenoxy)ethanoylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl (2R)-2-[2-(2-bromanyl-4-fluoranyl-phenoxy)ethanoylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl (2R)-2-[[2-(2-bromo-4-fluoro-phenoxy)acetyl]amino]-3-(1H-indol-3-yl)propanoate CAS Name: (2R)-2-[[2-(2-bromo-4-fluorophenoxy)-1-oxoethyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-(2-bromo-4-fluorophenoxy)acetyl]amino]-3-(1H-indol-3-yl)propanoate Traditional Name: (2R)-2-[[2-(2-bromo-4-fluoro-phenoxy)acetyl]amino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C20H18BrFN2O4 MolecularWeight: 449.270323

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)COC3=C(C=C(C=C3)F)Br

Isomeric SMILES

COC(=O)[C@@H](CC1=CNC2=CC=CC=C21)NC(=O)COC3=C(C=C(C=C3)F)Br

InChI

InChI=1S/C20H18BrFN2O4/c1-27-20(26)17(8-12-10-23-16-5-3-2-4-14(12)16)24-19(25)11-28-18-7-6-13(22)9-15(18)21/h2-7,9-10,17,23H,8,11H2,1H3,(H,24,25)/t17-/m1/s1