4-chloranyl-3,3-dimethyl-2-[(phenylmethyl)amino]butanenitrile

Systemtic Name: 4-chloranyl-3,3-dimethyl-2-[(phenylmethyl)amino]butanenitrile Openeye Name: 2-(benzylamino)-4-chloro-3,3-dimethyl-butanenitrile CAS Name: 4-chloro-3,3-dimethyl-2-[(phenylmethyl)amino]butanenitrile IUPAC Name: 2-(benzylamino)-4-chloro-3,3-dimethylbutanenitrile Traditional Name: 2-(benzylamino)-4-chloro-3,3-dimethyl-butyronitrile Formula: C13H17ClN2 MolecularWeight: 236.74048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCl)C(C#N)NCC1=CC=CC=C1

Isomeric SMILES

CC(C)(CCl)C(C#N)NCC1=CC=CC=C1

InChI

InChI=1S/C13H17ClN2/c1-13(2,10-14)12(8-15)16-9-11-6-4-3-5-7-11/h3-7,12,16H,9-10H2,1-2H3