N-(4-bromanyl-2-methyl-phenyl)-2-(2,4-dinitrophenoxy)ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-(2,4-dinitrophenoxy)ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-(2,4-dinitrophenoxy)acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-(2,4-dinitrophenoxy)acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-(2,4-dinitrophenoxy)acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-(2,4-dinitrophenoxy)acetamide Formula: C15H12BrN3O6 MolecularWeight: 410.17628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H12BrN3O6/c1-9-6-10(16)2-4-12(9)17-15(20)8-25-14-5-3-11(18(21)22)7-13(14)19(23)24/h2-7H,8H2,1H3,(H,17,20)