(2S)-2-(2-dimethylaminoethylamino)-2-(4-fluorophenyl)ethanenitrile

Systemtic Name: (2S)-2-(2-dimethylaminoethylamino)-2-(4-fluorophenyl)ethanenitrile Openeye Name: (2S)-2-(2-dimethylaminoethylamino)-2-(4-fluorophenyl)acetonitrile CAS Name: (2S)-2-(2-dimethylaminoethylamino)-2-(4-fluorophenyl)acetonitrile IUPAC Name: (2S)-2-(2-dimethylaminoethylamino)-2-(4-fluorophenyl)acetonitrile Traditional Name: (2S)-2-(2-dimethylaminoethylamino)-2-(4-fluorophenyl)acetonitrile Formula: C12H16FN3 MolecularWeight: 221.273943

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CN(C)CCN[C@H](C#N)C1=CC=C(C=C1)F

InChI

InChI=1S/C12H16FN3/c1-16(2)8-7-15-12(9-14)10-3-5-11(13)6-4-10/h3-6,12,15H,7-8H2,1-2H3/t12-/m1/s1