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

Systemtic Name: 4-[4-[3,4-bis(fluoranyl)phenyl]carbonylpiperazin-1-yl]-5-fluoranyl-2-methyl-benzenecarbonitrile Openeye Name: 4-[4-(3,4-difluorobenzoyl)piperazin-1-yl]-5-fluoro-2-methyl-benzonitrile CAS Name: 4-[4-[(3,4-difluorophenyl)-oxomethyl]-1-piperazinyl]-5-fluoro-2-methylbenzonitrile IUPAC Name: 4-[4-(3,4-difluorobenzoyl)piperazin-1-yl]-5-fluoro-2-methylbenzonitrile Traditional Name: 4-[4-(3,4-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=CC(=C(C=C3)F)F

Isomeric SMILES

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

InChI

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