5-ethanoyl-2-[(2-fluoranyl-4-iodanyl-phenyl)amino]-1H-pyrrole-3-carboxylic acid

Systemtic Name: 5-ethanoyl-2-[(2-fluoranyl-4-iodanyl-phenyl)amino]-1H-pyrrole-3-carboxylic acid Openeye Name: 5-acetyl-2-(2-fluoro-4-iodo-anilino)-1H-pyrrole-3-carboxylic acid CAS Name: 5-acetyl-2-(2-fluoro-4-iodoanilino)-1H-pyrrole-3-carboxylic acid IUPAC Name: 5-acetyl-2-(2-fluoro-4-iodoanilino)-1H-pyrrole-3-carboxylic acid Traditional Name: 5-acetyl-2-(2-fluoro-4-iodo-anilino)-1H-pyrrole-3-carboxylic acid Formula: C13H10FIN2O3 MolecularWeight: 388.132973

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(N1)NC2=C(C=C(C=C2)I)F)C(=O)O

Isomeric SMILES

CC(=O)C1=CC(=C(N1)NC2=C(C=C(C=C2)I)F)C(=O)O

InChI

InChI=1S/C13H10FIN2O3/c1-6(18)11-5-8(13(19)20)12(17-11)16-10-3-2-7(15)4-9(10)14/h2-5,16-17H,1H3,(H,19,20)