2-(3-oxidanyl-1-adamantyl)-N-[(2,4,5-trimethoxyphenyl)methyl]ethanamide

Systemtic Name: 2-(3-oxidanyl-1-adamantyl)-N-[(2,4,5-trimethoxyphenyl)methyl]ethanamide Openeye Name: 2-(3-hydroxy-1-adamantyl)-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide CAS Name: 2-(3-hydroxy-1-adamantyl)-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide IUPAC Name: 2-(3-hydroxy-1-adamantyl)-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide Traditional Name: 2-(3-hydroxy-1-adamantyl)-N-(2,4,5-trimethoxybenzyl)acetamide Formula: C22H31NO5 MolecularWeight: 389.48524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CNC(=O)CC23CC4CC(C2)CC(C4)(C3)O)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1CNC(=O)CC23CC4CC(C2)CC(C4)(C3)O)OC)OC

InChI

InChI=1S/C22H31NO5/c1-26-17-6-19(28-3)18(27-2)5-16(17)12-23-20(24)11-21-7-14-4-15(8-21)10-22(25,9-14)13-21/h5-6,14-15,25H,4,7-13H2,1-3H3,(H,23,24)