4-[6-(2-chloranyl-4-nitro-phenoxy)hexyl]heptane-3,5-dione

Systemtic Name: 4-[6-(2-chloranyl-4-nitro-phenoxy)hexyl]heptane-3,5-dione Openeye Name: 4-[6-(2-chloro-4-nitro-phenoxy)hexyl]heptane-3,5-dione CAS Name: 4-[6-(2-chloro-4-nitrophenoxy)hexyl]heptane-3,5-dione IUPAC Name: 4-[6-(2-chloro-4-nitrophenoxy)hexyl]heptane-3,5-dione Traditional Name: 4-[6-(2-chloro-4-nitro-phenoxy)hexyl]heptane-3,5-dione Formula: C19H26ClNO5 MolecularWeight: 383.86644

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(CCCCCCOC1=C(C=C(C=C1)[N+](=O)[O-])Cl)C(=O)CC

Isomeric SMILES

CCC(=O)C(CCCCCCOC1=C(C=C(C=C1)[N+](=O)[O-])Cl)C(=O)CC

InChI

InChI=1S/C19H26ClNO5/c1-3-17(22)15(18(23)4-2)9-7-5-6-8-12-26-19-11-10-14(21(24)25)13-16(19)20/h10-11,13,15H,3-9,12H2,1-2H3