3-[5-bromanyl-2-[(3-nitrophenyl)methoxy]phenyl]-2-(2-fluorophenyl)prop-2-enenitrile

Systemtic Name: 3-[5-bromanyl-2-[(3-nitrophenyl)methoxy]phenyl]-2-(2-fluorophenyl)prop-2-enenitrile Openeye Name: 3-[5-bromo-2-[(3-nitrophenyl)methoxy]phenyl]-2-(2-fluorophenyl)prop-2-enenitrile CAS Name: 3-[5-bromo-2-[(3-nitrophenyl)methoxy]phenyl]-2-(2-fluorophenyl)-2-propenenitrile IUPAC Name: 3-[5-bromo-2-[(3-nitrophenyl)methoxy]phenyl]-2-(2-fluorophenyl)prop-2-enenitrile Traditional Name: 3-[5-bromo-2-(3-nitrobenzyl)oxy-phenyl]-2-(2-fluorophenyl)acrylonitrile Formula: C22H14BrFN2O3 MolecularWeight: 453.260563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=CC2=C(C=CC(=C2)Br)OCC3=CC(=CC=C3)[N+](=O)[O-])C#N)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=CC2=C(C=CC(=C2)Br)OCC3=CC(=CC=C3)[N+](=O)[O-])C#N)F

InChI

InChI=1S/C22H14BrFN2O3/c23-18-8-9-22(29-14-15-4-3-5-19(10-15)26(27)28)16(12-18)11-17(13-25)20-6-1-2-7-21(20)24/h1-12H,14H2