ethyl 3,5-dimethyl-4-(4-methyl-5-oxidanylidene-1,2-dihydropyrazol-3-yl)-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 3,5-dimethyl-4-(4-methyl-5-oxidanylidene-1,2-dihydropyrazol-3-yl)-1H-pyrrole-2-carboxylate Openeye Name: ethyl 3,5-dimethyl-4-(4-methyl-5-oxo-1,2-dihydropyrazol-3-yl)-1H-pyrrole-2-carboxylate CAS Name: 3,5-dimethyl-4-(4-methyl-5-oxo-1,2-dihydropyrazol-3-yl)-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3,5-dimethyl-4-(4-methyl-5-oxo-1,2-dihydropyrazol-3-yl)-1H-pyrrole-2-carboxylate Traditional Name: 4-(5-keto-4-methyl-3-pyrazolin-3-yl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C13H17N3O3 MolecularWeight: 263.29238

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C2=C(C(=O)NN2)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C2=C(C(=O)NN2)C)C

InChI

InChI=1S/C13H17N3O3/c1-5-19-13(18)11-6(2)9(8(4)14-11)10-7(3)12(17)16-15-10/h14H,5H2,1-4H3,(H2,15,16,17)