2-(3-bromanyl-1-adamantyl)-N-(2-chloranyl-4,5-dimethoxy-phenyl)ethanamide

Systemtic Name: 2-(3-bromanyl-1-adamantyl)-N-(2-chloranyl-4,5-dimethoxy-phenyl)ethanamide Openeye Name: 2-(3-bromo-1-adamantyl)-N-(2-chloro-4,5-dimethoxy-phenyl)acetamide CAS Name: 2-(3-bromo-1-adamantyl)-N-(2-chloro-4,5-dimethoxyphenyl)acetamide IUPAC Name: 2-(3-bromo-1-adamantyl)-N-(2-chloro-4,5-dimethoxyphenyl)acetamide Traditional Name: 2-(3-bromo-1-adamantyl)-N-(2-chloro-4,5-dimethoxy-phenyl)acetamide Formula: C20H25BrClNO3 MolecularWeight: 442.7744

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25BrClNO3/c1-25-16-4-14(22)15(5-17(16)26-2)23-18(24)10-19-6-12-3-13(7-19)9-20(21,8-12)11-19/h4-5,12-13H,3,6-11H2,1-2H3,(H,23,24)