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

Systemtic Name: 2-[2-(4-bromanyl-2,6-dimethyl-phenoxy)ethanoylamino]-N-butyl-benzamide Openeye Name: 2-[[2-(4-bromo-2,6-dimethyl-phenoxy)acetyl]amino]-N-butyl-benzamide CAS Name: 2-[[2-(4-bromo-2,6-dimethylphenoxy)-1-oxoethyl]amino]-N-butylbenzamide IUPAC Name: 2-[[2-(4-bromo-2,6-dimethylphenoxy)acetyl]amino]-N-butylbenzamide Traditional Name: 2-[[2-(4-bromo-2,6-dimethyl-phenoxy)acetyl]amino]-N-butyl-benzamide Formula: C21H25BrN2O3 MolecularWeight: 433.3388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=CC=C1NC(=O)COC2=C(C=C(C=C2C)Br)C

Isomeric SMILES

CCCCNC(=O)C1=CC=CC=C1NC(=O)COC2=C(C=C(C=C2C)Br)C

InChI

InChI=1S/C21H25BrN2O3/c1-4-5-10-23-21(26)17-8-6-7-9-18(17)24-19(25)13-27-20-14(2)11-16(22)12-15(20)3/h6-9,11-12H,4-5,10,13H2,1-3H3,(H,23,26)(H,24,25)