2-fluoranyl-6-[4-[(E)-3-(3-nitrophenyl)prop-2-enoyl]piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-6-[4-[(E)-3-(3-nitrophenyl)prop-2-enoyl]piperazin-1-yl]benzenecarbonitrile Openeye Name: 2-fluoro-6-[4-[(E)-3-(3-nitrophenyl)prop-2-enoyl]piperazin-1-yl]benzonitrile CAS Name: 2-fluoro-6-[4-[(E)-3-(3-nitrophenyl)-1-oxoprop-2-enyl]-1-piperazinyl]benzonitrile IUPAC Name: 2-fluoro-6-[4-[(E)-3-(3-nitrophenyl)prop-2-enoyl]piperazin-1-yl]benzonitrile Traditional Name: 2-fluoro-6-[4-[(E)-3-(3-nitrophenyl)acryloyl]piperazino]benzonitrile Formula: C20H17FN4O3 MolecularWeight: 380.372383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=CC=C2)F)C#N)C(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=C(C(=CC=C2)F)C#N)C(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H17FN4O3/c21-18-5-2-6-19(17(18)14-22)23-9-11-24(12-10-23)20(26)8-7-15-3-1-4-16(13-15)25(27)28/h1-8,13H,9-12H2/b8-7+