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

Systemtic Name: 4-[4-[2,3-bis(fluoranyl)-4-methyl-phenyl]carbonylpiperazin-1-yl]-5-fluoranyl-2-methyl-benzenecarbonitrile Openeye Name: 4-[4-(2,3-difluoro-4-methyl-benzoyl)piperazin-1-yl]-5-fluoro-2-methyl-benzonitrile CAS Name: 4-[4-[(2,3-difluoro-4-methylphenyl)-oxomethyl]-1-piperazinyl]-5-fluoro-2-methylbenzonitrile IUPAC Name: 4-[4-(2,3-difluoro-4-methylbenzoyl)piperazin-1-yl]-5-fluoro-2-methylbenzonitrile Traditional Name: 4-[4-(2,3-difluoro-4-methyl-benzoyl)piperazino]-5-fluoro-2-methyl-benzonitrile Formula: C20H18F3N3O MolecularWeight: 373.37163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C(=C3)C)C#N)F)F)F

Isomeric SMILES

CC1=C(C(=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C(=C3)C)C#N)F)F)F

InChI

InChI=1S/C20H18F3N3O/c1-12-3-4-15(19(23)18(12)22)20(27)26-7-5-25(6-8-26)17-9-13(2)14(11-24)10-16(17)21/h3-4,9-10H,5-8H2,1-2H3