2-[(4-bromanyl-2,6-dimethyl-phenyl)amino]-N-(cyanomethyl)ethanamide

Systemtic Name: 2-[(4-bromanyl-2,6-dimethyl-phenyl)amino]-N-(cyanomethyl)ethanamide Openeye Name: 2-(4-bromo-2,6-dimethyl-anilino)-N-(cyanomethyl)acetamide CAS Name: 2-(4-bromo-2,6-dimethylanilino)-N-(cyanomethyl)acetamide IUPAC Name: 2-(4-bromo-2,6-dimethylanilino)-N-(cyanomethyl)acetamide Traditional Name: 2-(4-bromo-2,6-dimethyl-anilino)-N-(cyanomethyl)acetamide Formula: C12H14BrN3O MolecularWeight: 296.16306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NCC(=O)NCC#N)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1NCC(=O)NCC#N)C)Br

InChI

InChI=1S/C12H14BrN3O/c1-8-5-10(13)6-9(2)12(8)16-7-11(17)15-4-3-14/h5-6,16H,4,7H2,1-2H3,(H,15,17)