2-(4-bromanylphenoxy)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]ethanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]ethanamide Openeye Name: 2-(4-bromophenoxy)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]acetamide CAS Name: 2-(4-bromophenoxy)-N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]acetamide IUPAC Name: 2-(4-bromophenoxy)-N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]acetamide Traditional Name: 2-(4-bromophenoxy)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]acetamide Formula: C18H19BrN2O6 MolecularWeight: 439.25726

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)COC2=CC=C(C=C2)Br)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)COC2=CC=C(C=C2)Br)[N+](=O)[O-])OC

InChI

InChI=1S/C18H19BrN2O6/c1-25-16-9-12(15(21(23)24)10-17(16)26-2)7-8-20-18(22)11-27-14-5-3-13(19)4-6-14/h3-6,9-10H,7-8,11H2,1-2H3,(H,20,22)