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

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl 3-acetamido-3-(4-chlorophenyl)propanoate Openeye Name: (4-bromo-2-fluoro-phenyl)methyl 3-acetamido-3-(4-chlorophenyl)propanoate CAS Name: 3-acetamido-3-(4-chlorophenyl)propanoic acid (4-bromo-2-fluorophenyl)methyl ester IUPAC Name: (4-bromo-2-fluorophenyl)methyl 3-acetamido-3-(4-chlorophenyl)propanoate Traditional Name: 3-acetamido-3-(4-chlorophenyl)propionic acid (4-bromo-2-fluoro-benzyl) ester Formula: C18H16BrClFNO3 MolecularWeight: 428.679943

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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=C(C=C2)Cl

Isomeric SMILES

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

InChI

InChI=1S/C18H16BrClFNO3/c1-11(23)22-17(12-3-6-15(20)7-4-12)9-18(24)25-10-13-2-5-14(19)8-16(13)21/h2-8,17H,9-10H2,1H3,(H,22,23)