5-(2-methoxy-5-nitro-phenoxy)pentanoic acid

Systemtic Name: 5-(2-methoxy-5-nitro-phenoxy)pentanoic acid Openeye Name: 5-(2-methoxy-5-nitro-phenoxy)pentanoic acid CAS Name: 5-(2-methoxy-5-nitrophenoxy)pentanoic acid IUPAC Name: 5-(2-methoxy-5-nitrophenoxy)pentanoic acid Traditional Name: 5-(2-methoxy-5-nitro-phenoxy)valeric acid Formula: C12H15NO6 MolecularWeight: 269.2506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])OCCCCC(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])OCCCCC(=O)O

InChI

InChI=1S/C12H15NO6/c1-18-10-6-5-9(13(16)17)8-11(10)19-7-3-2-4-12(14)15/h5-6,8H,2-4,7H2,1H3,(H,14,15)