3-[(4-bromanylphenoxy)methyl]-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]benzamide

Systemtic Name: 3-[(4-bromanylphenoxy)methyl]-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]benzamide Openeye Name: 3-[(4-bromophenoxy)methyl]-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]benzamide CAS Name: 3-[(4-bromophenoxy)methyl]-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]benzamide IUPAC Name: 3-[(4-bromophenoxy)methyl]-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]benzamide Traditional Name: 3-[(4-bromophenoxy)methyl]-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]benzamide Formula: C29H25BrN2O5 MolecularWeight: 561.4232

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H25BrN2O5/c1-18-11-19(2)20(3)28(12-18)37-27-15-24(14-25(16-27)32(34)35)31-29(33)22-6-4-5-21(13-22)17-36-26-9-7-23(30)8-10-26/h4-16H,17H2,1-3H3,(H,31,33)