3-[(E)-3-(3-bromanyl-4-fluoranyl-phenyl)-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile

Systemtic Name: 3-[(E)-3-(3-bromanyl-4-fluoranyl-phenyl)-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile Openeye Name: 3-[(E)-3-(3-bromo-4-fluoro-phenyl)-3-oxo-prop-1-enyl]benzonitrile CAS Name: 3-[(E)-3-(3-bromo-4-fluorophenyl)-3-oxoprop-1-enyl]benzonitrile IUPAC Name: 3-[(E)-3-(3-bromo-4-fluorophenyl)-3-oxoprop-1-enyl]benzonitrile Traditional Name: 3-[(E)-3-(3-bromo-4-fluoro-phenyl)-3-keto-prop-1-enyl]benzonitrile Formula: C16H9BrFNO MolecularWeight: 330.151163

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H9BrFNO/c17-14-9-13(5-6-15(14)18)16(20)7-4-11-2-1-3-12(8-11)10-19/h1-9H/b7-4+