2-[(E)-3-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-yl]-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile

Systemtic Name: 2-[(E)-3-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-yl]-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile Openeye Name: 2-[(E)-3-[4-(4-acetyl-2-fluoro-phenyl)piperazin-1-yl]-3-oxo-prop-1-enyl]benzonitrile CAS Name: 2-[(E)-3-[4-(4-acetyl-2-fluorophenyl)-1-piperazinyl]-3-oxoprop-1-enyl]benzonitrile IUPAC Name: 2-[(E)-3-[4-(4-acetyl-2-fluorophenyl)piperazin-1-yl]-3-oxoprop-1-enyl]benzonitrile Traditional Name: 2-[(E)-3-[4-(4-acetyl-2-fluoro-phenyl)piperazino]-3-keto-prop-1-enyl]benzonitrile Formula: C22H20FN3O2 MolecularWeight: 377.411503

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C=CC3=CC=CC=C3C#N)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)/C=C/C3=CC=CC=C3C#N)F

InChI

InChI=1S/C22H20FN3O2/c1-16(27)18-6-8-21(20(23)14-18)25-10-12-26(13-11-25)22(28)9-7-17-4-2-3-5-19(17)15-24/h2-9,14H,10-13H2,1H3/b9-7+