N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-2-(2-nitrophenoxy)ethanamide

Systemtic Name: N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-2-(2-nitrophenoxy)ethanamide Openeye Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-2-(2-nitrophenoxy)acetamide CAS Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-2-(2-nitrophenoxy)acetamide IUPAC Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-2-(2-nitrophenoxy)acetamide Traditional Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-2-(2-nitrophenoxy)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=CC=C2[N+](=O)[O-])Br)OC

Isomeric SMILES

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

InChI

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