4-methoxy-1-[2-(4-nitropyrazol-1-yl)ethanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 4-methoxy-1-[2-(4-nitropyrazol-1-yl)ethanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 4-methoxy-1-[2-(4-nitropyrazol-1-yl)acetyl]pyrrolidine-2-carboxylic acid CAS Name: 4-methoxy-1-[2-(4-nitro-1-pyrazolyl)-1-oxoethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 4-methoxy-1-[2-(4-nitropyrazol-1-yl)acetyl]pyrrolidine-2-carboxylic acid Traditional Name: 4-methoxy-1-[2-(4-nitropyrazol-1-yl)acetyl]proline Formula: C11H14N4O6 MolecularWeight: 298.25206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1CC(N(C1)C(=O)CN2C=C(C=N2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

COC1CC(N(C1)C(=O)CN2C=C(C=N2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C11H14N4O6/c1-21-8-2-9(11(17)18)14(5-8)10(16)6-13-4-7(3-12-13)15(19)20/h3-4,8-9H,2,5-6H2,1H3,(H,17,18)