4-(3-methoxy-4-nitro-pyrazol-1-yl)butanoic acid

Systemtic Name: 4-(3-methoxy-4-nitro-pyrazol-1-yl)butanoic acid Openeye Name: 4-(3-methoxy-4-nitro-pyrazol-1-yl)butanoic acid CAS Name: 4-(3-methoxy-4-nitro-1-pyrazolyl)butanoic acid IUPAC Name: 4-(3-methoxy-4-nitropyrazol-1-yl)butanoic acid Traditional Name: 4-(3-methoxy-4-nitro-pyrazol-1-yl)butyric acid Formula: C8H11N3O5 MolecularWeight: 229.19004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H11N3O5/c1-16-8-6(11(14)15)5-10(9-8)4-2-3-7(12)13/h5H,2-4H2,1H3,(H,12,13)