4-[4-[2,3-bis(fluoranyl)phenyl]carbonylpiperazin-1-yl]-5-fluoranyl-2-methyl-benzenecarbonitrile

Systemtic Name: 4-[4-[2,3-bis(fluoranyl)phenyl]carbonylpiperazin-1-yl]-5-fluoranyl-2-methyl-benzenecarbonitrile Openeye Name: 4-[4-(2,3-difluorobenzoyl)piperazin-1-yl]-5-fluoro-2-methyl-benzonitrile CAS Name: 4-[4-[(2,3-difluorophenyl)-oxomethyl]-1-piperazinyl]-5-fluoro-2-methylbenzonitrile IUPAC Name: 4-[4-(2,3-difluorobenzoyl)piperazin-1-yl]-5-fluoro-2-methylbenzonitrile Traditional Name: 4-[4-(2,3-difluorobenzoyl)piperazino]-5-fluoro-2-methyl-benzonitrile Formula: C19H16F3N3O MolecularWeight: 359.34505

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C#N)F)N2CCN(CC2)C(=O)C3=C(C(=CC=C3)F)F

Isomeric SMILES

CC1=CC(=C(C=C1C#N)F)N2CCN(CC2)C(=O)C3=C(C(=CC=C3)F)F

InChI

InChI=1S/C19H16F3N3O/c1-12-9-17(16(21)10-13(12)11-23)24-5-7-25(8-6-24)19(26)14-3-2-4-15(20)18(14)22/h2-4,9-10H,5-8H2,1H3