4-[1,1,1-tris(chloranyl)-3-nitro-propan-2-yl]oxybutan-1-ol

Systemtic Name: 4-[1,1,1-tris(chloranyl)-3-nitro-propan-2-yl]oxybutan-1-ol Openeye Name: 4-[2,2,2-trichloro-1-(nitromethyl)ethoxy]butan-1-ol CAS Name: 4-(1,1,1-trichloro-3-nitropropan-2-yl)oxy-1-butanol IUPAC Name: 4-(1,1,1-trichloro-3-nitropropan-2-yl)oxybutan-1-ol Traditional Name: 4-[2,2,2-trichloro-1-(nitromethyl)ethoxy]butan-1-ol Formula: C7H12Cl3NO4 MolecularWeight: 280.53348

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Descriptors Computed from Structure

Canonical SMILES:

C(CCOC(C[N+](=O)[O-])C(Cl)(Cl)Cl)CO

Isomeric SMILES

C(CCOC(C[N+](=O)[O-])C(Cl)(Cl)Cl)CO

InChI

InChI=1S/C7H12Cl3NO4/c8-7(9,10)6(5-11(13)14)15-4-2-1-3-12/h6,12H,1-5H2