3-[2,6-bis(bromanyl)-4-nitro-phenoxy]propanoate

Systemtic Name: 3-[2,6-bis(bromanyl)-4-nitro-phenoxy]propanoate Openeye Name: 3-(2,6-dibromo-4-nitro-phenoxy)propanoate CAS Name: 3-(2,6-dibromo-4-nitrophenoxy)propanoate IUPAC Name: 3-(2,6-dibromo-4-nitrophenoxy)propanoate Traditional Name: 3-(2,6-dibromo-4-nitro-phenoxy)propionate Formula: C9H6Br2NO5- MolecularWeight: 367.95564

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Br)OCCC(=O)[O-])Br)[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=C1Br)OCCC(=O)[O-])Br)[N+](=O)[O-]

InChI

InChI=1S/C9H7Br2NO5/c10-6-3-5(12(15)16)4-7(11)9(6)17-2-1-8(13)14/h3-4H,1-2H2,(H,13,14)/p-1