2-azanyl-N-(2-bromanyl-4-cyano-phenyl)-3-methyl-pentanamide

Systemtic Name: 2-azanyl-N-(2-bromanyl-4-cyano-phenyl)-3-methyl-pentanamide Openeye Name: 2-amino-N-(2-bromo-4-cyano-phenyl)-3-methyl-pentanamide CAS Name: 2-amino-N-(2-bromo-4-cyanophenyl)-3-methylpentanamide IUPAC Name: 2-amino-N-(2-bromo-4-cyanophenyl)-3-methylpentanamide Traditional Name: 2-amino-N-(2-bromo-4-cyano-phenyl)-3-methyl-valeramide Formula: C13H16BrN3O MolecularWeight: 310.18964

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=C(C=C(C=C1)C#N)Br)N

Isomeric SMILES

CCC(C)C(C(=O)NC1=C(C=C(C=C1)C#N)Br)N

InChI

InChI=1S/C13H16BrN3O/c1-3-8(2)12(16)13(18)17-11-5-4-9(7-15)6-10(11)14/h4-6,8,12H,3,16H2,1-2H3,(H,17,18)