N-[(1S,2R)-2-(cyanomethylcarbamoyl)cyclohexyl]-4-phenyl-benzamide

Systemtic Name: N-[(1S,2R)-2-(cyanomethylcarbamoyl)cyclohexyl]-4-phenyl-benzamide Openeye Name: N-[(1S,2R)-2-(cyanomethylcarbamoyl)cyclohexyl]-4-phenyl-benzamide CAS Name: N-[(1S,2R)-2-[(cyanomethylamino)-oxomethyl]cyclohexyl]-4-phenylbenzamide IUPAC Name: N-[(1S,2R)-2-(cyanomethylcarbamoyl)cyclohexyl]-4-phenylbenzamide Traditional Name: N-[(1S,2R)-2-(cyanomethylcarbamoyl)cyclohexyl]-4-phenyl-benzamide Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NCC#N)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

C1CC[C@@H]([C@@H](C1)C(=O)NCC#N)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H23N3O2/c23-14-15-24-22(27)19-8-4-5-9-20(19)25-21(26)18-12-10-17(11-13-18)16-6-2-1-3-7-16/h1-3,6-7,10-13,19-20H,4-5,8-9,15H2,(H,24,27)(H,25,26)/t19-,20+/m1/s1