4-[2-(3-bromanyl-1-adamantyl)ethanoylamino]-N-(2-methoxyphenyl)benzamide

Systemtic Name: 4-[2-(3-bromanyl-1-adamantyl)ethanoylamino]-N-(2-methoxyphenyl)benzamide Openeye Name: 4-[[2-(3-bromo-1-adamantyl)acetyl]amino]-N-(2-methoxyphenyl)benzamide CAS Name: 4-[[2-(3-bromo-1-adamantyl)-1-oxoethyl]amino]-N-(2-methoxyphenyl)benzamide IUPAC Name: 4-[[2-(3-bromo-1-adamantyl)acetyl]amino]-N-(2-methoxyphenyl)benzamide Traditional Name: 4-[[2-(3-bromo-1-adamantyl)acetyl]amino]-N-(2-methoxyphenyl)benzamide Formula: C26H29BrN2O3 MolecularWeight: 497.42406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)NC(=O)CC34CC5CC(C3)CC(C5)(C4)Br

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)NC(=O)CC34CC5CC(C3)CC(C5)(C4)Br

InChI

InChI=1S/C26H29BrN2O3/c1-32-22-5-3-2-4-21(22)29-24(31)19-6-8-20(9-7-19)28-23(30)15-25-11-17-10-18(12-25)14-26(27,13-17)16-25/h2-9,17-18H,10-16H2,1H3,(H,28,30)(H,29,31)