(E)-3-(3-bromanyl-5-nitro-4-oxidanyl-phenyl)-2-cyano-N-(4-fluorophenyl)prop-2-enamide

Systemtic Name: (E)-3-(3-bromanyl-5-nitro-4-oxidanyl-phenyl)-2-cyano-N-(4-fluorophenyl)prop-2-enamide Openeye Name: (E)-3-(3-bromo-4-hydroxy-5-nitro-phenyl)-2-cyano-N-(4-fluorophenyl)prop-2-enamide CAS Name: (E)-3-(3-bromo-4-hydroxy-5-nitrophenyl)-2-cyano-N-(4-fluorophenyl)-2-propenamide IUPAC Name: (E)-3-(3-bromo-4-hydroxy-5-nitrophenyl)-2-cyano-N-(4-fluorophenyl)prop-2-enamide Traditional Name: (E)-3-(3-bromo-4-hydroxy-5-nitro-phenyl)-2-cyano-N-(4-fluorophenyl)acrylamide Formula: C16H9BrFN3O4 MolecularWeight: 406.162763

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C(=CC2=CC(=C(C(=C2)Br)O)[N+](=O)[O-])C#N)F

Isomeric SMILES

C1=CC(=CC=C1NC(=O)/C(=C/C2=CC(=C(C(=C2)Br)O)[N+](=O)[O-])/C#N)F

InChI

InChI=1S/C16H9BrFN3O4/c17-13-6-9(7-14(15(13)22)21(24)25)5-10(8-19)16(23)20-12-3-1-11(18)2-4-12/h1-7,22H,(H,20,23)/b10-5+