3-[(4-bromanylphenoxy)methyl]-N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]benzamide

Systemtic Name: 3-[(4-bromanylphenoxy)methyl]-N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]benzamide Openeye Name: 3-[(4-bromophenoxy)methyl]-N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]benzamide CAS Name: 3-[(4-bromophenoxy)methyl]-N-[3-(3,5-dimethylphenoxy)-5-nitrophenyl]benzamide IUPAC Name: 3-[(4-bromophenoxy)methyl]-N-[3-(3,5-dimethylphenoxy)-5-nitrophenyl]benzamide Traditional Name: 3-[(4-bromophenoxy)methyl]-N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]benzamide Formula: C28H23BrN2O5 MolecularWeight: 547.39662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC(=CC=C3)COC4=CC=C(C=C4)Br)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC(=CC=C3)COC4=CC=C(C=C4)Br)C

InChI

InChI=1S/C28H23BrN2O5/c1-18-10-19(2)12-26(11-18)36-27-15-23(14-24(16-27)31(33)34)30-28(32)21-5-3-4-20(13-21)17-35-25-8-6-22(29)7-9-25/h3-16H,17H2,1-2H3,(H,30,32)