2-(3-bromanyl-1-adamantyl)-N-[(2,5-dimethoxyphenyl)methyl]ethanamide

Systemtic Name: 2-(3-bromanyl-1-adamantyl)-N-[(2,5-dimethoxyphenyl)methyl]ethanamide Openeye Name: 2-(3-bromo-1-adamantyl)-N-[(2,5-dimethoxyphenyl)methyl]acetamide CAS Name: 2-(3-bromo-1-adamantyl)-N-[(2,5-dimethoxyphenyl)methyl]acetamide IUPAC Name: 2-(3-bromo-1-adamantyl)-N-[(2,5-dimethoxyphenyl)methyl]acetamide Traditional Name: 2-(3-bromo-1-adamantyl)-N-(2,5-dimethoxybenzyl)acetamide Formula: C21H28BrNO3 MolecularWeight: 422.35592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28BrNO3/c1-25-17-3-4-18(26-2)16(6-17)12-23-19(24)11-20-7-14-5-15(8-20)10-21(22,9-14)13-20/h3-4,6,14-15H,5,7-13H2,1-2H3,(H,23,24)