4-[6-(2-nitrophenoxy)hexyl]heptane-3,5-dione

Systemtic Name: 4-[6-(2-nitrophenoxy)hexyl]heptane-3,5-dione Openeye Name: 4-[6-(2-nitrophenoxy)hexyl]heptane-3,5-dione CAS Name: 4-[6-(2-nitrophenoxy)hexyl]heptane-3,5-dione IUPAC Name: 4-[6-(2-nitrophenoxy)hexyl]heptane-3,5-dione Traditional Name: 4-[6-(2-nitrophenoxy)hexyl]heptane-3,5-dione Formula: C19H27NO5 MolecularWeight: 349.42138

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27NO5/c1-3-17(21)15(18(22)4-2)11-7-5-6-10-14-25-19-13-9-8-12-16(19)20(23)24/h8-9,12-13,15H,3-7,10-11,14H2,1-2H3