methyl 4-(2-chloranylpyridin-3-yl)-5-ethanoyl-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 4-(2-chloranylpyridin-3-yl)-5-ethanoyl-1H-pyrrole-2-carboxylate Openeye Name: methyl 5-acetyl-4-(2-chloro-3-pyridyl)-1H-pyrrole-2-carboxylate CAS Name: 5-acetyl-4-(2-chloro-3-pyridinyl)-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 5-acetyl-4-(2-chloropyridin-3-yl)-1H-pyrrole-2-carboxylate Traditional Name: 5-acetyl-4-(2-chloro-3-pyridyl)-1H-pyrrole-2-carboxylic acid methyl ester Formula: C13H11ClN2O3 MolecularWeight: 278.69104

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C(N1)C(=O)OC)C2=C(N=CC=C2)Cl

Isomeric SMILES

CC(=O)C1=C(C=C(N1)C(=O)OC)C2=C(N=CC=C2)Cl

InChI

InChI=1S/C13H11ClN2O3/c1-7(17)11-9(6-10(16-11)13(18)19-2)8-4-3-5-15-12(8)14/h3-6,16H,1-2H3