3-chloranyl-N-[2-(cyanomethylcarbamoyl)cyclohexyl]-4-methyl-benzamide

Systemtic Name: 3-chloranyl-N-[2-(cyanomethylcarbamoyl)cyclohexyl]-4-methyl-benzamide Openeye Name: 3-chloro-N-[2-(cyanomethylcarbamoyl)cyclohexyl]-4-methyl-benzamide CAS Name: 3-chloro-N-[2-[(cyanomethylamino)-oxomethyl]cyclohexyl]-4-methylbenzamide IUPAC Name: 3-chloro-N-[2-(cyanomethylcarbamoyl)cyclohexyl]-4-methylbenzamide Traditional Name: 3-chloro-N-[2-(cyanomethylcarbamoyl)cyclohexyl]-4-methyl-benzamide Formula: C17H20ClN3O2 MolecularWeight: 333.8126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CCCCC2C(=O)NCC#N)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CCCCC2C(=O)NCC#N)Cl

InChI

InChI=1S/C17H20ClN3O2/c1-11-6-7-12(10-14(11)18)16(22)21-15-5-3-2-4-13(15)17(23)20-9-8-19/h6-7,10,13,15H,2-5,9H2,1H3,(H,20,23)(H,21,22)