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

Systemtic Name: 4-[6-(4-nitrophenoxy)hexyl]heptane-3,5-dione Openeye Name: 4-[6-(4-nitrophenoxy)hexyl]heptane-3,5-dione CAS Name: 4-[6-(4-nitrophenoxy)hexyl]heptane-3,5-dione IUPAC Name: 4-[6-(4-nitrophenoxy)hexyl]heptane-3,5-dione Traditional Name: 4-[6-(4-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=C(C=C1)[N+](=O)[O-])C(=O)CC

Isomeric SMILES

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

InChI

InChI=1S/C19H27NO5/c1-3-18(21)17(19(22)4-2)9-7-5-6-8-14-25-16-12-10-15(11-13-16)20(23)24/h10-13,17H,3-9,14H2,1-2H3