(4-bromanyl-2-fluoranyl-phenyl)methyl 3-(4-cyanophenyl)propanoate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl 3-(4-cyanophenyl)propanoate Openeye Name: (4-bromo-2-fluoro-phenyl)methyl 3-(4-cyanophenyl)propanoate CAS Name: 3-(4-cyanophenyl)propanoic acid (4-bromo-2-fluorophenyl)methyl ester IUPAC Name: (4-bromo-2-fluorophenyl)methyl 3-(4-cyanophenyl)propanoate Traditional Name: 3-(4-cyanophenyl)propionic acid (4-bromo-2-fluoro-benzyl) ester Formula: C17H13BrFNO2 MolecularWeight: 362.193023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)OCC2=C(C=C(C=C2)Br)F)C#N

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)OCC2=C(C=C(C=C2)Br)F)C#N

InChI

InChI=1S/C17H13BrFNO2/c18-15-7-6-14(16(19)9-15)11-22-17(21)8-5-12-1-3-13(10-20)4-2-12/h1-4,6-7,9H,5,8,11H2