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

Systemtic Name: 4-[(E)-3-(3-fluoranyl-4-pyrrolidin-1-yl-phenyl)-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile Openeye Name: 4-[(E)-3-(3-fluoro-4-pyrrolidin-1-yl-phenyl)-3-oxo-prop-1-enyl]benzonitrile CAS Name: 4-[(E)-3-[3-fluoro-4-(1-pyrrolidinyl)phenyl]-3-oxoprop-1-enyl]benzonitrile IUPAC Name: 4-[(E)-3-(3-fluoro-4-pyrrolidin-1-ylphenyl)-3-oxoprop-1-enyl]benzonitrile Traditional Name: 4-[(E)-3-(3-fluoro-4-pyrrolidino-phenyl)-3-keto-prop-1-enyl]benzonitrile Formula: C20H17FN2O MolecularWeight: 320.360183

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)C=CC3=CC=C(C=C3)C#N)F

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)/C=C/C3=CC=C(C=C3)C#N)F

InChI

InChI=1S/C20H17FN2O/c21-18-13-17(8-9-19(18)23-11-1-2-12-23)20(24)10-7-15-3-5-16(14-22)6-4-15/h3-10,13H,1-2,11-12H2/b10-7+