5,5-diethyl-4H-pyrazole-3,3-dicarboxylic acid

Systemtic Name: 5,5-diethyl-4H-pyrazole-3,3-dicarboxylic acid Openeye Name: 5,5-diethyl-4H-pyrazole-3,3-dicarboxylic acid CAS Name: 5,5-diethyl-4H-pyrazole-3,3-dicarboxylic acid IUPAC Name: 5,5-diethyl-4H-pyrazole-3,3-dicarboxylic acid Traditional Name: 5,5-diethyl-1-pyrazoline-3,3-dicarboxylic acid Formula: C9H14N2O4 MolecularWeight: 214.21846

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(N=N1)(C(=O)O)C(=O)O)CC

Isomeric SMILES

CCC1(CC(N=N1)(C(=O)O)C(=O)O)CC

InChI

InChI=1S/C9H14N2O4/c1-3-8(4-2)5-9(6(12)13,7(14)15)11-10-8/h3-5H2,1-2H3,(H,12,13)(H,14,15)