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

Systemtic Name: N-[1-(cyanomethylcarbamoyl)cyclohexyl]-4-phenyl-benzamide Openeye Name: N-[1-(cyanomethylcarbamoyl)cyclohexyl]-4-phenyl-benzamide CAS Name: N-[1-[(cyanomethylamino)-oxomethyl]cyclohexyl]-4-phenylbenzamide IUPAC Name: N-[1-(cyanomethylcarbamoyl)cyclohexyl]-4-phenylbenzamide Traditional Name: N-[1-(cyanomethylcarbamoyl)cyclohexyl]-4-phenyl-benzamide Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)NCC#N)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)(C(=O)NCC#N)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H23N3O2/c23-15-16-24-21(27)22(13-5-2-6-14-22)25-20(26)19-11-9-18(10-12-19)17-7-3-1-4-8-17/h1,3-4,7-12H,2,5-6,13-14,16H2,(H,24,27)(H,25,26)