4-[(E)-2-cyano-3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-2-cyano-3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile Openeye Name: 4-[(E)-2-cyano-3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxo-prop-1-enyl]benzonitrile CAS Name: 4-[(E)-2-cyano-3-[4-(2-fluorophenyl)-1-piperazinyl]-3-oxoprop-1-enyl]benzonitrile IUPAC Name: 4-[(E)-2-cyano-3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxoprop-1-enyl]benzonitrile Traditional Name: 4-[(E)-2-cyano-3-[4-(2-fluorophenyl)piperazino]-3-keto-prop-1-enyl]benzonitrile Formula: C21H17FN4O MolecularWeight: 360.384283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2F)C(=O)C(=CC3=CC=C(C=C3)C#N)C#N

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2F)C(=O)/C(=C/C3=CC=C(C=C3)C#N)/C#N

InChI

InChI=1S/C21H17FN4O/c22-19-3-1-2-4-20(19)25-9-11-26(12-10-25)21(27)18(15-24)13-16-5-7-17(14-23)8-6-16/h1-8,13H,9-12H2/b18-13+