1-(4-cyano-1H-pyrazol-5-yl)-4-ethanoyl-5-methyl-pyrrole-2-carboxylic acid

Systemtic Name: 1-(4-cyano-1H-pyrazol-5-yl)-4-ethanoyl-5-methyl-pyrrole-2-carboxylic acid Openeye Name: 4-acetyl-1-(4-cyano-1H-pyrazol-5-yl)-5-methyl-pyrrole-2-carboxylic acid CAS Name: 4-acetyl-1-(4-cyano-1H-pyrazol-5-yl)-5-methyl-2-pyrrolecarboxylic acid IUPAC Name: 4-acetyl-1-(4-cyano-1H-pyrazol-5-yl)-5-methylpyrrole-2-carboxylic acid Traditional Name: 4-acetyl-1-(4-cyano-1H-pyrazol-5-yl)-5-methyl-pyrrole-2-carboxylic acid Formula: C12H10N4O3 MolecularWeight: 258.2328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C2=C(C=NN2)C#N)C(=O)O)C(=O)C

Isomeric SMILES

CC1=C(C=C(N1C2=C(C=NN2)C#N)C(=O)O)C(=O)C

InChI

InChI=1S/C12H10N4O3/c1-6-9(7(2)17)3-10(12(18)19)16(6)11-8(4-13)5-14-15-11/h3,5H,1-2H3,(H,14,15)(H,18,19)