4-fluoranyl-3-[[(2-methyl-1-oxidanyl-propan-2-yl)amino]methyl]benzenecarbonitrile

Systemtic Name: 4-fluoranyl-3-[[(2-methyl-1-oxidanyl-propan-2-yl)amino]methyl]benzenecarbonitrile Openeye Name: 4-fluoro-3-[[(2-hydroxy-1,1-dimethyl-ethyl)amino]methyl]benzonitrile CAS Name: 4-fluoro-3-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]benzonitrile IUPAC Name: 4-fluoro-3-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]benzonitrile Traditional Name: 4-fluoro-3-[[(2-hydroxy-1,1-dimethyl-ethyl)amino]methyl]benzonitrile Formula: C12H15FN2O MolecularWeight: 222.258703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)NCC1=C(C=CC(=C1)C#N)F

Isomeric SMILES

CC(C)(CO)NCC1=C(C=CC(=C1)C#N)F

InChI

InChI=1S/C12H15FN2O/c1-12(2,8-16)15-7-10-5-9(6-14)3-4-11(10)13/h3-5,15-16H,7-8H2,1-2H3