4-(5-bromanylpyridin-3-yl)carbonyl-1-methyl-pyrrole-2-carboxylic acid

Systemtic Name: 4-(5-bromanylpyridin-3-yl)carbonyl-1-methyl-pyrrole-2-carboxylic acid Openeye Name: 4-(5-bromopyridine-3-carbonyl)-1-methyl-pyrrole-2-carboxylic acid CAS Name: 4-[(5-bromo-3-pyridinyl)-oxomethyl]-1-methyl-2-pyrrolecarboxylic acid IUPAC Name: 4-(5-bromopyridine-3-carbonyl)-1-methylpyrrole-2-carboxylic acid Traditional Name: 4-(5-bromonicotinoyl)-1-methyl-pyrrole-2-carboxylic acid Formula: C12H9BrN2O3 MolecularWeight: 309.11546

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)O)C(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

CN1C=C(C=C1C(=O)O)C(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C12H9BrN2O3/c1-15-6-8(3-10(15)12(17)18)11(16)7-2-9(13)5-14-4-7/h2-6H,1H3,(H,17,18)