4-(2-methylpiperazin-1-yl)-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-(2-methylpiperazin-1-yl)-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-(2-methylpiperazin-1-yl)-2-(trifluoromethyl)benzonitrile CAS Name: 4-(2-methyl-1-piperazinyl)-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-(2-methylpiperazin-1-yl)-2-(trifluoromethyl)benzonitrile Traditional Name: 4-(2-methylpiperazino)-2-(trifluoromethyl)benzonitrile Formula: C13H14F3N3 MolecularWeight: 269.26557

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNCCN1C2=CC(=C(C=C2)C#N)C(F)(F)F

Isomeric SMILES

CC1CNCCN1C2=CC(=C(C=C2)C#N)C(F)(F)F

InChI

InChI=1S/C13H14F3N3/c1-9-8-18-4-5-19(9)11-3-2-10(7-17)12(6-11)13(14,15)16/h2-3,6,9,18H,4-5,8H2,1H3