3-bromanyl-N-(2-cyanoethyl)-5-fluoranyl-N-phenyl-benzamide

Systemtic Name: 3-bromanyl-N-(2-cyanoethyl)-5-fluoranyl-N-phenyl-benzamide Openeye Name: 3-bromo-N-(2-cyanoethyl)-5-fluoro-N-phenyl-benzamide CAS Name: 3-bromo-N-(2-cyanoethyl)-5-fluoro-N-phenylbenzamide IUPAC Name: 3-bromo-N-(2-cyanoethyl)-5-fluoro-N-phenylbenzamide Traditional Name: 3-bromo-N-(2-cyanoethyl)-5-fluoro-N-phenyl-benzamide Formula: C16H12BrFN2O MolecularWeight: 347.181683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12BrFN2O/c17-13-9-12(10-14(18)11-13)16(21)20(8-4-7-19)15-5-2-1-3-6-15/h1-3,5-6,9-11H,4,8H2