2-(3-bromanyl-1-adamantyl)-N-(2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethanamide

Systemtic Name: 2-(3-bromanyl-1-adamantyl)-N-(2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethanamide Openeye Name: 2-(3-bromo-1-adamantyl)-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)acetamide CAS Name: 2-(3-bromo-1-adamantyl)-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)acetamide IUPAC Name: 2-(3-bromo-1-adamantyl)-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)acetamide Traditional Name: 2-(3-bromo-1-adamantyl)-N-(3-keto-2-methyl-4H-1,4-benzoxazin-6-yl)acetamide Formula: C21H25BrN2O3 MolecularWeight: 433.3388

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)CC34CC5CC(C3)CC(C5)(C4)Br

Isomeric SMILES

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)CC34CC5CC(C3)CC(C5)(C4)Br

InChI

InChI=1S/C21H25BrN2O3/c1-12-19(26)24-16-5-15(2-3-17(16)27-12)23-18(25)10-20-6-13-4-14(7-20)9-21(22,8-13)11-20/h2-3,5,12-14H,4,6-11H2,1H3,(H,23,25)(H,24,26)