4-(bromomethyl)-N-[1-(cyanomethylcarbamoyl)cyclohexyl]benzamide

Systemtic Name: 4-(bromomethyl)-N-[1-(cyanomethylcarbamoyl)cyclohexyl]benzamide Openeye Name: 4-(bromomethyl)-N-[1-(cyanomethylcarbamoyl)cyclohexyl]benzamide CAS Name: 4-(bromomethyl)-N-[1-[(cyanomethylamino)-oxomethyl]cyclohexyl]benzamide IUPAC Name: 4-(bromomethyl)-N-[1-(cyanomethylcarbamoyl)cyclohexyl]benzamide Traditional Name: 4-(bromomethyl)-N-[1-(cyanomethylcarbamoyl)cyclohexyl]benzamide Formula: C17H20BrN3O2 MolecularWeight: 378.2636

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)NCC#N)NC(=O)C2=CC=C(C=C2)CBr

Isomeric SMILES

C1CCC(CC1)(C(=O)NCC#N)NC(=O)C2=CC=C(C=C2)CBr

InChI

InChI=1S/C17H20BrN3O2/c18-12-13-4-6-14(7-5-13)15(22)21-17(8-2-1-3-9-17)16(23)20-11-10-19/h4-7H,1-3,8-9,11-12H2,(H,20,23)(H,21,22)