(E)-3-(4-bromanyl-2-fluoranyl-phenyl)-2-cyano-N-propan-2-yl-prop-2-enamide

Systemtic Name: (E)-3-(4-bromanyl-2-fluoranyl-phenyl)-2-cyano-N-propan-2-yl-prop-2-enamide Openeye Name: (E)-3-(4-bromo-2-fluoro-phenyl)-2-cyano-N-isopropyl-prop-2-enamide CAS Name: (E)-3-(4-bromo-2-fluorophenyl)-2-cyano-N-propan-2-yl-2-propenamide IUPAC Name: (E)-3-(4-bromo-2-fluorophenyl)-2-cyano-N-propan-2-ylprop-2-enamide Traditional Name: (E)-3-(4-bromo-2-fluoro-phenyl)-2-cyano-N-isopropyl-acrylamide Formula: C13H12BrFN2O MolecularWeight: 311.149583

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(=CC1=C(C=C(C=C1)Br)F)C#N

Isomeric SMILES

CC(C)NC(=O)/C(=C/C1=C(C=C(C=C1)Br)F)/C#N

InChI

InChI=1S/C13H12BrFN2O/c1-8(2)17-13(18)10(7-16)5-9-3-4-11(14)6-12(9)15/h3-6,8H,1-2H3,(H,17,18)/b10-5+