5-bromanyl-N-(2-methoxy-5-nitro-phenyl)-2-phenethyloxy-benzamide

Systemtic Name: 5-bromanyl-N-(2-methoxy-5-nitro-phenyl)-2-phenethyloxy-benzamide Openeye Name: 5-bromo-N-(2-methoxy-5-nitro-phenyl)-2-phenethyloxy-benzamide CAS Name: 5-bromo-N-(2-methoxy-5-nitrophenyl)-2-phenethyloxybenzamide IUPAC Name: 5-bromo-N-(2-methoxy-5-nitrophenyl)-2-phenethyloxybenzamide Traditional Name: 5-bromo-N-(2-methoxy-5-nitro-phenyl)-2-phenethyloxy-benzamide Formula: C22H19BrN2O5 MolecularWeight: 471.30066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=C(C=CC(=C2)Br)OCCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=C(C=CC(=C2)Br)OCCC3=CC=CC=C3

InChI

InChI=1S/C22H19BrN2O5/c1-29-21-10-8-17(25(27)28)14-19(21)24-22(26)18-13-16(23)7-9-20(18)30-12-11-15-5-3-2-4-6-15/h2-10,13-14H,11-12H2,1H3,(H,24,26)