4-bromanyl-3-(cyanomethyl)-N-(2-methylpropyl)-2-(phenylcarbonyl)benzamide

Systemtic Name: 4-bromanyl-3-(cyanomethyl)-N-(2-methylpropyl)-2-(phenylcarbonyl)benzamide Openeye Name: 2-benzoyl-4-bromo-3-(cyanomethyl)-N-isobutyl-benzamide CAS Name: 2-benzoyl-4-bromo-3-(cyanomethyl)-N-(2-methylpropyl)benzamide IUPAC Name: 2-benzoyl-4-bromo-3-(cyanomethyl)-N-(2-methylpropyl)benzamide Traditional Name: 2-benzoyl-4-bromo-3-(cyanomethyl)-N-isobutyl-benzamide Formula: C20H19BrN2O2 MolecularWeight: 399.28106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=C(C(=C(C=C1)Br)CC#N)C(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)CNC(=O)C1=C(C(=C(C=C1)Br)CC#N)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H19BrN2O2/c1-13(2)12-23-20(25)16-8-9-17(21)15(10-11-22)18(16)19(24)14-6-4-3-5-7-14/h3-9,13H,10,12H2,1-2H3,(H,23,25)