4-[2-(4-bromanyl-2,6-dimethyl-phenoxy)ethanoylamino]-N-(1-phenylethyl)benzamide

Systemtic Name: 4-[2-(4-bromanyl-2,6-dimethyl-phenoxy)ethanoylamino]-N-(1-phenylethyl)benzamide Openeye Name: 4-[[2-(4-bromo-2,6-dimethyl-phenoxy)acetyl]amino]-N-(1-phenylethyl)benzamide CAS Name: 4-[[2-(4-bromo-2,6-dimethylphenoxy)-1-oxoethyl]amino]-N-(1-phenylethyl)benzamide IUPAC Name: 4-[[2-(4-bromo-2,6-dimethylphenoxy)acetyl]amino]-N-(1-phenylethyl)benzamide Traditional Name: 4-[[2-(4-bromo-2,6-dimethyl-phenoxy)acetyl]amino]-N-(1-phenylethyl)benzamide Formula: C25H25BrN2O3 MolecularWeight: 481.3816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NC2=CC=C(C=C2)C(=O)NC(C)C3=CC=CC=C3)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)NC2=CC=C(C=C2)C(=O)NC(C)C3=CC=CC=C3)C)Br

InChI

InChI=1S/C25H25BrN2O3/c1-16-13-21(26)14-17(2)24(16)31-15-23(29)28-22-11-9-20(10-12-22)25(30)27-18(3)19-7-5-4-6-8-19/h4-14,18H,15H2,1-3H3,(H,27,30)(H,28,29)