4-[2,2-dimethylpropyl(3-oxidanylpropyl)amino]-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-[2,2-dimethylpropyl(3-oxidanylpropyl)amino]-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-[2,2-dimethylpropyl(3-hydroxypropyl)amino]-2-(trifluoromethyl)benzonitrile CAS Name: 4-[2,2-dimethylpropyl(3-hydroxypropyl)amino]-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-[2,2-dimethylpropyl(3-hydroxypropyl)amino]-2-(trifluoromethyl)benzonitrile Traditional Name: 4-[3-hydroxypropyl(neopentyl)amino]-2-(trifluoromethyl)benzonitrile Formula: C16H21F3N2O MolecularWeight: 314.34595

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN(CCCO)C1=CC(=C(C=C1)C#N)C(F)(F)F

Isomeric SMILES

CC(C)(C)CN(CCCO)C1=CC(=C(C=C1)C#N)C(F)(F)F

InChI

InChI=1S/C16H21F3N2O/c1-15(2,3)11-21(7-4-8-22)13-6-5-12(10-20)14(9-13)16(17,18)19/h5-6,9,22H,4,7-8,11H2,1-3H3