N-(1-adamantylcarbamoyl)-2-[2,4-bis(bromanyl)-6-ethanoyl-phenoxy]ethanamide

Systemtic Name: N-(1-adamantylcarbamoyl)-2-[2,4-bis(bromanyl)-6-ethanoyl-phenoxy]ethanamide Openeye Name: 2-(2-acetyl-4,6-dibromo-phenoxy)-N-(1-adamantylcarbamoyl)acetamide CAS Name: 2-(2-acetyl-4,6-dibromophenoxy)-N-[(1-adamantylamino)-oxomethyl]acetamide IUPAC Name: 2-(2-acetyl-4,6-dibromophenoxy)-N-(1-adamantylcarbamoyl)acetamide Traditional Name: 2-(2-acetyl-4,6-dibromo-phenoxy)-N-(1-adamantylcarbamoyl)acetamide Formula: C21H24Br2N2O4 MolecularWeight: 528.23426

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC(=C1OCC(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3)Br)Br

Isomeric SMILES

CC(=O)C1=CC(=CC(=C1OCC(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3)Br)Br

InChI

InChI=1S/C21H24Br2N2O4/c1-11(26)16-5-15(22)6-17(23)19(16)29-10-18(27)24-20(28)25-21-7-12-2-13(8-21)4-14(3-12)9-21/h5-6,12-14H,2-4,7-10H2,1H3,(H2,24,25,27,28)