2-[4-[(1-adamantylamino)methyl]-2-iodanyl-6-methoxy-phenoxy]ethanamide

Systemtic Name: 2-[4-[(1-adamantylamino)methyl]-2-iodanyl-6-methoxy-phenoxy]ethanamide Openeye Name: 2-[4-[(1-adamantylamino)methyl]-2-iodo-6-methoxy-phenoxy]acetamide CAS Name: 2-[4-[(1-adamantylamino)methyl]-2-iodo-6-methoxyphenoxy]acetamide IUPAC Name: 2-[4-[(1-adamantylamino)methyl]-2-iodo-6-methoxyphenoxy]acetamide Traditional Name: 2-[4-[(1-adamantylamino)methyl]-2-iodo-6-methoxy-phenoxy]acetamide Formula: C20H27IN2O3 MolecularWeight: 470.34445

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNC23CC4CC(C2)CC(C4)C3)I)OCC(=O)N

Isomeric SMILES

COC1=C(C(=CC(=C1)CNC23CC4CC(C2)CC(C4)C3)I)OCC(=O)N

InChI

InChI=1S/C20H27IN2O3/c1-25-17-6-15(5-16(21)19(17)26-11-18(22)24)10-23-20-7-12-2-13(8-20)4-14(3-12)9-20/h5-6,12-14,23H,2-4,7-11H2,1H3,(H2,22,24)