5-[1,1,1-tris(chloranyl)-3-nitro-propan-2-yl]oxypentanoic acid

Systemtic Name: 5-[1,1,1-tris(chloranyl)-3-nitro-propan-2-yl]oxypentanoic acid Openeye Name: 5-[2,2,2-trichloro-1-(nitromethyl)ethoxy]pentanoic acid CAS Name: 5-(1,1,1-trichloro-3-nitropropan-2-yl)oxypentanoic acid IUPAC Name: 5-(1,1,1-trichloro-3-nitropropan-2-yl)oxypentanoic acid Traditional Name: 5-[2,2,2-trichloro-1-(nitromethyl)ethoxy]valeric acid Formula: C8H12Cl3NO5 MolecularWeight: 308.54358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H12Cl3NO5/c9-8(10,11)6(5-12(15)16)17-4-2-1-3-7(13)14/h6H,1-5H2,(H,13,14)