2-[[1-(2-chlorophenyl)cyclopropyl]methyl]-2-oxidanyl-N-(1-oxidanylidene-3H-2-benzofuran-5-yl)but-3-ynamide

Systemtic Name: 2-[[1-(2-chlorophenyl)cyclopropyl]methyl]-2-oxidanyl-N-(1-oxidanylidene-3H-2-benzofuran-5-yl)but-3-ynamide Openeye Name: 2-[[1-(2-chlorophenyl)cyclopropyl]methyl]-2-hydroxy-N-(1-oxo-3H-isobenzofuran-5-yl)but-3-ynamide CAS Name: 2-[[1-(2-chlorophenyl)cyclopropyl]methyl]-2-hydroxy-N-(1-oxo-3H-isobenzofuran-5-yl)-3-butynamide IUPAC Name: 2-[[1-(2-chlorophenyl)cyclopropyl]methyl]-2-hydroxy-N-(1-oxo-3H-2-benzofuran-5-yl)but-3-ynamide Traditional Name: 2-[[1-(2-chlorophenyl)cyclopropyl]methyl]-2-hydroxy-N-(1-ketophthalan-5-yl)but-3-ynamide Formula: C22H18ClNO4 MolecularWeight: 395.83562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CC(CC1(CC1)C2=CC=CC=C2Cl)(C(=O)NC3=CC4=C(C=C3)C(=O)OC4)O

Isomeric SMILES

C#CC(CC1(CC1)C2=CC=CC=C2Cl)(C(=O)NC3=CC4=C(C=C3)C(=O)OC4)O

InChI

InChI=1S/C22H18ClNO4/c1-2-22(27,13-21(9-10-21)17-5-3-4-6-18(17)23)20(26)24-15-7-8-16-14(11-15)12-28-19(16)25/h1,3-8,11,27H,9-10,12-13H2,(H,24,26)