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

Systemtic Name: 5-ethanoyl-2-[(2-fluoranyl-4-iodanyl-phenyl)amino]-1-methyl-pyrrole-3-carboxylic acid Openeye Name: 5-acetyl-2-(2-fluoro-4-iodo-anilino)-1-methyl-pyrrole-3-carboxylic acid CAS Name: 5-acetyl-2-(2-fluoro-4-iodoanilino)-1-methyl-3-pyrrolecarboxylic acid IUPAC Name: 5-acetyl-2-(2-fluoro-4-iodoanilino)-1-methylpyrrole-3-carboxylic acid Traditional Name: 5-acetyl-2-(2-fluoro-4-iodo-anilino)-1-methyl-pyrrole-3-carboxylic acid Formula: C14H12FIN2O3 MolecularWeight: 402.159553

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(N1C)NC2=C(C=C(C=C2)I)F)C(=O)O

Isomeric SMILES

CC(=O)C1=CC(=C(N1C)NC2=C(C=C(C=C2)I)F)C(=O)O

InChI

InChI=1S/C14H12FIN2O3/c1-7(19)12-6-9(14(20)21)13(18(12)2)17-11-4-3-8(16)5-10(11)15/h3-6,17H,1-2H3,(H,20,21)