4-(3,3-dimethylpiperazin-1-yl)-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-(3,3-dimethylpiperazin-1-yl)-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-(3,3-dimethylpiperazin-1-yl)-2-(trifluoromethyl)benzonitrile CAS Name: 4-(3,3-dimethyl-1-piperazinyl)-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-(3,3-dimethylpiperazin-1-yl)-2-(trifluoromethyl)benzonitrile Traditional Name: 4-(3,3-dimethylpiperazino)-2-(trifluoromethyl)benzonitrile Formula: C14H16F3N3 MolecularWeight: 283.29215

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CCN1)C2=CC(=C(C=C2)C#N)C(F)(F)F)C

Isomeric SMILES

CC1(CN(CCN1)C2=CC(=C(C=C2)C#N)C(F)(F)F)C

InChI

InChI=1S/C14H16F3N3/c1-13(2)9-20(6-5-19-13)11-4-3-10(8-18)12(7-11)14(15,16)17/h3-4,7,19H,5-6,9H2,1-2H3