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

Systemtic Name: 2-(4-bromanylphenoxy)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]propanamide Openeye Name: 2-(4-bromophenoxy)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]propanamide CAS Name: 2-(4-bromophenoxy)-N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]propanamide IUPAC Name: 2-(4-bromophenoxy)-N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]propanamide Traditional Name: 2-(4-bromophenoxy)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]propionamide Formula: C19H21BrN2O6 MolecularWeight: 453.28384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC(=C(C=C1[N+](=O)[O-])OC)OC)OC2=CC=C(C=C2)Br

Isomeric SMILES

CC(C(=O)NCCC1=CC(=C(C=C1[N+](=O)[O-])OC)OC)OC2=CC=C(C=C2)Br

InChI

InChI=1S/C19H21BrN2O6/c1-12(28-15-6-4-14(20)5-7-15)19(23)21-9-8-13-10-17(26-2)18(27-3)11-16(13)22(24)25/h4-7,10-12H,8-9H2,1-3H3,(H,21,23)