5-bromanyl-N-(2-methyl-3-nitro-phenyl)-2-phenethyloxy-benzamide

Systemtic Name: 5-bromanyl-N-(2-methyl-3-nitro-phenyl)-2-phenethyloxy-benzamide Openeye Name: 5-bromo-N-(2-methyl-3-nitro-phenyl)-2-phenethyloxy-benzamide CAS Name: 5-bromo-N-(2-methyl-3-nitrophenyl)-2-phenethyloxybenzamide IUPAC Name: 5-bromo-N-(2-methyl-3-nitrophenyl)-2-phenethyloxybenzamide Traditional Name: 5-bromo-N-(2-methyl-3-nitro-phenyl)-2-phenethyloxy-benzamide Formula: C22H19BrN2O4 MolecularWeight: 455.30126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C2=C(C=CC(=C2)Br)OCCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C2=C(C=CC(=C2)Br)OCCC3=CC=CC=C3

InChI

InChI=1S/C22H19BrN2O4/c1-15-19(8-5-9-20(15)25(27)28)24-22(26)18-14-17(23)10-11-21(18)29-13-12-16-6-3-2-4-7-16/h2-11,14H,12-13H2,1H3,(H,24,26)