N-[4-[4-(2-bromanyl-4-tert-butyl-phenoxy)butanoylamino]-2,5-dimethoxy-phenyl]benzamide

Systemtic Name: N-[4-[4-(2-bromanyl-4-tert-butyl-phenoxy)butanoylamino]-2,5-dimethoxy-phenyl]benzamide Openeye Name: N-[4-[4-(2-bromo-4-tert-butyl-phenoxy)butanoylamino]-2,5-dimethoxy-phenyl]benzamide CAS Name: N-[4-[[4-(2-bromo-4-tert-butylphenoxy)-1-oxobutyl]amino]-2,5-dimethoxyphenyl]benzamide IUPAC Name: N-[4-[4-(2-bromo-4-tert-butylphenoxy)butanoylamino]-2,5-dimethoxyphenyl]benzamide Traditional Name: N-[4-[4-(2-bromo-4-tert-butyl-phenoxy)butanoylamino]-2,5-dimethoxy-phenyl]benzamide Formula: C29H33BrN2O5 MolecularWeight: 569.48672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H33BrN2O5/c1-29(2,3)20-13-14-24(21(30)16-20)37-15-9-12-27(33)31-22-17-26(36-5)23(18-25(22)35-4)32-28(34)19-10-7-6-8-11-19/h6-8,10-11,13-14,16-18H,9,12,15H2,1-5H3,(H,31,33)(H,32,34)