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4-(4-methanoyl-2-methoxy-3-nitro-phenoxy)butanoic acid

4-(4-methanoyl-2-methoxy-3-nitro-phenoxy)butanoic acid

Systemtic Name:4-(4-methanoyl-2-methoxy-3-nitro-phenoxy)butanoic acid
Openeye Name:4-(4-formyl-2-methoxy-3-nitro-phenoxy)butanoic acid
CAS Name:4-(4-formyl-2-methoxy-3-nitrophenoxy)butanoic acid
IUPAC Name:4-(4-formyl-2-methoxy-3-nitrophenoxy)butanoic acid
Traditional Name:4-(4-formyl-2-methoxy-3-nitro-phenoxy)butyric acid
Formula: C12H13NO7
MolecularWeight: 283.23412
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C12H13NO7/c1-19-12-9(20-6-2-3-10(15)16)5-4-8(7-14)11(12)13(17)18/h4-5,7H,2-3,6H2,1H3,(H,15,16)


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