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

Systemtic Name: N-[4-[4-(2-bromanyl-4-methyl-phenoxy)butanoylamino]-2,5-dimethoxy-phenyl]benzamide Openeye Name: N-[4-[4-(2-bromo-4-methyl-phenoxy)butanoylamino]-2,5-dimethoxy-phenyl]benzamide CAS Name: N-[4-[[4-(2-bromo-4-methylphenoxy)-1-oxobutyl]amino]-2,5-dimethoxyphenyl]benzamide IUPAC Name: N-[4-[4-(2-bromo-4-methylphenoxy)butanoylamino]-2,5-dimethoxyphenyl]benzamide Traditional Name: N-[4-[4-(2-bromo-4-methyl-phenoxy)butanoylamino]-2,5-dimethoxy-phenyl]benzamide Formula: C26H27BrN2O5 MolecularWeight: 527.40698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCCC(=O)NC2=C(C=C(C(=C2)OC)NC(=O)C3=CC=CC=C3)OC)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OCCCC(=O)NC2=C(C=C(C(=C2)OC)NC(=O)C3=CC=CC=C3)OC)Br

InChI

InChI=1S/C26H27BrN2O5/c1-17-11-12-22(19(27)14-17)34-13-7-10-25(30)28-20-15-24(33-3)21(16-23(20)32-2)29-26(31)18-8-5-4-6-9-18/h4-6,8-9,11-12,14-16H,7,10,13H2,1-3H3,(H,28,30)(H,29,31)