2-(3-bromanyl-1-adamantyl)-N-(2,4-dimethoxyphenyl)ethanamide

Systemtic Name: 2-(3-bromanyl-1-adamantyl)-N-(2,4-dimethoxyphenyl)ethanamide Openeye Name: 2-(3-bromo-1-adamantyl)-N-(2,4-dimethoxyphenyl)acetamide CAS Name: 2-(3-bromo-1-adamantyl)-N-(2,4-dimethoxyphenyl)acetamide IUPAC Name: 2-(3-bromo-1-adamantyl)-N-(2,4-dimethoxyphenyl)acetamide Traditional Name: 2-(3-bromo-1-adamantyl)-N-(2,4-dimethoxyphenyl)acetamide Formula: C20H26BrNO3 MolecularWeight: 408.32934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)CC23CC4CC(C2)CC(C4)(C3)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)CC23CC4CC(C2)CC(C4)(C3)Br)OC

InChI

InChI=1S/C20H26BrNO3/c1-24-15-3-4-16(17(6-15)25-2)22-18(23)11-19-7-13-5-14(8-19)10-20(21,9-13)12-19/h3-4,6,13-14H,5,7-12H2,1-2H3,(H,22,23)