6-(3-methanoyl-2-nitro-phenoxy)hexanoic acid

Systemtic Name: 6-(3-methanoyl-2-nitro-phenoxy)hexanoic acid Openeye Name: 6-(3-formyl-2-nitro-phenoxy)hexanoic acid CAS Name: 6-(3-formyl-2-nitrophenoxy)hexanoic acid IUPAC Name: 6-(3-formyl-2-nitrophenoxy)hexanoic acid Traditional Name: 6-(3-formyl-2-nitro-phenoxy)hexanoic acid Formula: C13H15NO6 MolecularWeight: 281.2613

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO6/c15-9-10-5-4-6-11(13(10)14(18)19)20-8-3-1-2-7-12(16)17/h4-6,9H,1-3,7-8H2,(H,16,17)