N-[4-[4-(2-bromanyl-4-ethyl-phenoxy)butanoylamino]-2,5-diethoxy-phenyl]benzamide

Systemtic Name: N-[4-[4-(2-bromanyl-4-ethyl-phenoxy)butanoylamino]-2,5-diethoxy-phenyl]benzamide Openeye Name: N-[4-[4-(2-bromo-4-ethyl-phenoxy)butanoylamino]-2,5-diethoxy-phenyl]benzamide CAS Name: N-[4-[[4-(2-bromo-4-ethylphenoxy)-1-oxobutyl]amino]-2,5-diethoxyphenyl]benzamide IUPAC Name: N-[4-[4-(2-bromo-4-ethylphenoxy)butanoylamino]-2,5-diethoxyphenyl]benzamide Traditional Name: N-[4-[4-(2-bromo-4-ethyl-phenoxy)butanoylamino]-2,5-diethoxy-phenyl]benzamide Formula: C29H33BrN2O5 MolecularWeight: 569.48672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCCCC(=O)NC2=C(C=C(C(=C2)OCC)NC(=O)C3=CC=CC=C3)OCC)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCCCC(=O)NC2=C(C=C(C(=C2)OCC)NC(=O)C3=CC=CC=C3)OCC)Br

InChI

InChI=1S/C29H33BrN2O5/c1-4-20-14-15-25(22(30)17-20)37-16-10-13-28(33)31-23-18-27(36-6-3)24(19-26(23)35-5-2)32-29(34)21-11-8-7-9-12-21/h7-9,11-12,14-15,17-19H,4-6,10,13,16H2,1-3H3,(H,31,33)(H,32,34)