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

Systemtic Name: N-[4-[4-(2-bromanyl-4-methyl-phenoxy)butanoylamino]-2,5-diethoxy-phenyl]benzamide Openeye Name: N-[4-[4-(2-bromo-4-methyl-phenoxy)butanoylamino]-2,5-diethoxy-phenyl]benzamide CAS Name: N-[4-[[4-(2-bromo-4-methylphenoxy)-1-oxobutyl]amino]-2,5-diethoxyphenyl]benzamide IUPAC Name: N-[4-[4-(2-bromo-4-methylphenoxy)butanoylamino]-2,5-diethoxyphenyl]benzamide Traditional Name: N-[4-[4-(2-bromo-4-methyl-phenoxy)butanoylamino]-2,5-diethoxy-phenyl]benzamide Formula: C28H31BrN2O5 MolecularWeight: 555.46014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OCC)NC(=O)CCCOC3=C(C=C(C=C3)C)Br

Isomeric SMILES

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OCC)NC(=O)CCCOC3=C(C=C(C=C3)C)Br

InChI

InChI=1S/C28H31BrN2O5/c1-4-34-25-18-23(31-28(33)20-10-7-6-8-11-20)26(35-5-2)17-22(25)30-27(32)12-9-15-36-24-14-13-19(3)16-21(24)29/h6-8,10-11,13-14,16-18H,4-5,9,12,15H2,1-3H3,(H,30,32)(H,31,33)