2-(2-bromanyl-4,5-diethoxy-phenyl)-N-[(5-nitro-2-oxidanyl-phenyl)methyl]ethanamide

Systemtic Name: 2-(2-bromanyl-4,5-diethoxy-phenyl)-N-[(5-nitro-2-oxidanyl-phenyl)methyl]ethanamide Openeye Name: 2-(2-bromo-4,5-diethoxy-phenyl)-N-[(2-hydroxy-5-nitro-phenyl)methyl]acetamide CAS Name: 2-(2-bromo-4,5-diethoxyphenyl)-N-[(2-hydroxy-5-nitrophenyl)methyl]acetamide IUPAC Name: 2-(2-bromo-4,5-diethoxyphenyl)-N-[(2-hydroxy-5-nitrophenyl)methyl]acetamide Traditional Name: 2-(2-bromo-4,5-diethoxy-phenyl)-N-(2-hydroxy-5-nitro-benzyl)acetamide Formula: C19H21BrN2O6 MolecularWeight: 453.28384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)CC(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])O)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)CC(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])O)Br)OCC

InChI

InChI=1S/C19H21BrN2O6/c1-3-27-17-8-12(15(20)10-18(17)28-4-2)9-19(24)21-11-13-7-14(22(25)26)5-6-16(13)23/h5-8,10,23H,3-4,9,11H2,1-2H3,(H,21,24)