4-[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylamino]-N-butyl-benzamide

Systemtic Name: 4-[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylamino]-N-butyl-benzamide Openeye Name: 4-[[2-(2-bromo-4-ethyl-phenoxy)acetyl]amino]-N-butyl-benzamide CAS Name: 4-[[2-(2-bromo-4-ethylphenoxy)-1-oxoethyl]amino]-N-butylbenzamide IUPAC Name: 4-[[2-(2-bromo-4-ethylphenoxy)acetyl]amino]-N-butylbenzamide Traditional Name: 4-[[2-(2-bromo-4-ethyl-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=C(C=C1)NC(=O)COC2=C(C=C(C=C2)CC)Br

Isomeric SMILES

CCCCNC(=O)C1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)CC)Br

InChI

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