(4-bromanyl-2-fluoranyl-phenyl)methyl (3R)-3-acetamido-3-phenyl-propanoate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl (3R)-3-acetamido-3-phenyl-propanoate Openeye Name: (4-bromo-2-fluoro-phenyl)methyl (3R)-3-acetamido-3-phenyl-propanoate CAS Name: (3R)-3-acetamido-3-phenylpropanoic acid (4-bromo-2-fluorophenyl)methyl ester IUPAC Name: (4-bromo-2-fluorophenyl)methyl (3R)-3-acetamido-3-phenylpropanoate Traditional Name: (3R)-3-acetamido-3-phenyl-propionic acid (4-bromo-2-fluoro-benzyl) ester Formula: C18H17BrFNO3 MolecularWeight: 394.234883

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)OCC1=C(C=C(C=C1)Br)F)C2=CC=CC=C2

Isomeric SMILES

CC(=O)N[C@H](CC(=O)OCC1=C(C=C(C=C1)Br)F)C2=CC=CC=C2

InChI

InChI=1S/C18H17BrFNO3/c1-12(22)21-17(13-5-3-2-4-6-13)10-18(23)24-11-14-7-8-15(19)9-16(14)20/h2-9,17H,10-11H2,1H3,(H,21,22)/t17-/m1/s1