(2S)-2-(tert-butylamino)-2-(2,4-dichlorophenyl)ethanenitrile

Systemtic Name: (2S)-2-(tert-butylamino)-2-(2,4-dichlorophenyl)ethanenitrile Openeye Name: (2S)-2-(tert-butylamino)-2-(2,4-dichlorophenyl)acetonitrile CAS Name: (2S)-2-(tert-butylamino)-2-(2,4-dichlorophenyl)acetonitrile IUPAC Name: (2S)-2-(tert-butylamino)-2-(2,4-dichlorophenyl)acetonitrile Traditional Name: (2S)-2-(tert-butylamino)-2-(2,4-dichlorophenyl)acetonitrile Formula: C12H14Cl2N2 MolecularWeight: 257.15896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(C#N)C1=C(C=C(C=C1)Cl)Cl

Isomeric SMILES

CC(C)(C)N[C@H](C#N)C1=C(C=C(C=C1)Cl)Cl

InChI

InChI=1S/C12H14Cl2N2/c1-12(2,3)16-11(7-15)9-5-4-8(13)6-10(9)14/h4-6,11,16H,1-3H3/t11-/m1/s1