1-methyl-5-propyl-pyrazole-4-carboxylate

Systemtic Name: 1-methyl-5-propyl-pyrazole-4-carboxylate Openeye Name: 1-methyl-5-propyl-pyrazole-4-carboxylate CAS Name: 1-methyl-5-propyl-4-pyrazolecarboxylate IUPAC Name: 1-methyl-5-propylpyrazole-4-carboxylate Traditional Name: 1-methyl-5-propyl-pyrazole-4-carboxylate Formula: C8H11N2O2- MolecularWeight: 167.18514

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=NN1C)C(=O)[O-]

Isomeric SMILES

CCCC1=C(C=NN1C)C(=O)[O-]

InChI

InChI=1S/C8H12N2O2/c1-3-4-7-6(8(11)12)5-9-10(7)2/h5H,3-4H2,1-2H3,(H,11,12)/p-1