1-methyl-3-(propylcarbamoyl)pyrazole-4-carboxylate

Systemtic Name: 1-methyl-3-(propylcarbamoyl)pyrazole-4-carboxylate Openeye Name: 1-methyl-3-(propylcarbamoyl)pyrazole-4-carboxylate CAS Name: 1-methyl-3-[oxo(propylamino)methyl]-4-pyrazolecarboxylate IUPAC Name: 1-methyl-3-(propylcarbamoyl)pyrazole-4-carboxylate Traditional Name: 1-methyl-3-(propylcarbamoyl)pyrazole-4-carboxylate Formula: C9H12N3O3- MolecularWeight: 210.20988

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=NN(C=C1C(=O)[O-])C

Isomeric SMILES

CCCNC(=O)C1=NN(C=C1C(=O)[O-])C

InChI

InChI=1S/C9H13N3O3/c1-3-4-10-8(13)7-6(9(14)15)5-12(2)11-7/h5H,3-4H2,1-2H3,(H,10,13)(H,14,15)/p-1