6-[1,1,1-tris(chloranyl)-3-nitro-propan-2-yl]oxyhexanoic acid

Systemtic Name: 6-[1,1,1-tris(chloranyl)-3-nitro-propan-2-yl]oxyhexanoic acid Openeye Name: 6-[2,2,2-trichloro-1-(nitromethyl)ethoxy]hexanoic acid CAS Name: 6-(1,1,1-trichloro-3-nitropropan-2-yl)oxyhexanoic acid IUPAC Name: 6-(1,1,1-trichloro-3-nitropropan-2-yl)oxyhexanoic acid Traditional Name: 6-[2,2,2-trichloro-1-(nitromethyl)ethoxy]hexanoic acid Formula: C9H14Cl3NO5 MolecularWeight: 322.57016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H14Cl3NO5/c10-9(11,12)7(6-13(16)17)18-5-3-1-2-4-8(14)15/h7H,1-6H2,(H,14,15)