(1R,2R)-N-(1-cyanocyclopropyl)-2-(1,3-dihydroisoindol-2-ylcarbonyl)cyclohexane-1-carboxamide

Systemtic Name: (1R,2R)-N-(1-cyanocyclopropyl)-2-(1,3-dihydroisoindol-2-ylcarbonyl)cyclohexane-1-carboxamide Openeye Name: (1R,2R)-N-(1-cyanocyclopropyl)-2-(isoindoline-2-carbonyl)cyclohexanecarboxamide CAS Name: (1R,2R)-N-(1-cyanocyclopropyl)-2-[1,3-dihydroisoindol-2-yl(oxo)methyl]-1-cyclohexanecarboxamide IUPAC Name: (1R,2R)-N-(1-cyanocyclopropyl)-2-(1,3-dihydroisoindole-2-carbonyl)cyclohexane-1-carboxamide Traditional Name: (1R,2R)-N-(1-cyanocyclopropyl)-2-(isoindoline-2-carbonyl)cyclohexanecarboxamide Formula: C20H23N3O2 MolecularWeight: 337.41552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NC2(CC2)C#N)C(=O)N3CC4=CC=CC=C4C3

Isomeric SMILES

C1CC[C@H]([C@@H](C1)C(=O)NC2(CC2)C#N)C(=O)N3CC4=CC=CC=C4C3

InChI

InChI=1S/C20H23N3O2/c21-13-20(9-10-20)22-18(24)16-7-3-4-8-17(16)19(25)23-11-14-5-1-2-6-15(14)12-23/h1-2,5-6,16-17H,3-4,7-12H2,(H,22,24)/t16-,17-/m1/s1