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

Systemtic Name: 2-[(4-bromanyl-2,6-dimethyl-phenyl)amino]-N-(2-cyanoethyl)ethanamide Openeye Name: 2-(4-bromo-2,6-dimethyl-anilino)-N-(2-cyanoethyl)acetamide CAS Name: 2-(4-bromo-2,6-dimethylanilino)-N-(2-cyanoethyl)acetamide IUPAC Name: 2-(4-bromo-2,6-dimethylanilino)-N-(2-cyanoethyl)acetamide Traditional Name: 2-(4-bromo-2,6-dimethyl-anilino)-N-(2-cyanoethyl)acetamide Formula: C13H16BrN3O MolecularWeight: 310.18964

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16BrN3O/c1-9-6-11(14)7-10(2)13(9)17-8-12(18)16-5-3-4-15/h6-7,17H,3,5,8H2,1-2H3,(H,16,18)