5-ethanoyl-2-[(2-fluoranyl-4-iodanyl-phenyl)amino]-1-methyl-N-(3-oxidanylpropyl)pyrrole-3-carboxamide

Systemtic Name: 5-ethanoyl-2-[(2-fluoranyl-4-iodanyl-phenyl)amino]-1-methyl-N-(3-oxidanylpropyl)pyrrole-3-carboxamide Openeye Name: 5-acetyl-2-(2-fluoro-4-iodo-anilino)-N-(3-hydroxypropyl)-1-methyl-pyrrole-3-carboxamide CAS Name: 5-acetyl-2-(2-fluoro-4-iodoanilino)-N-(3-hydroxypropyl)-1-methyl-3-pyrrolecarboxamide IUPAC Name: 5-acetyl-2-(2-fluoro-4-iodoanilino)-N-(3-hydroxypropyl)-1-methylpyrrole-3-carboxamide Traditional Name: 5-acetyl-2-(2-fluoro-4-iodo-anilino)-N-(3-hydroxypropyl)-1-methyl-pyrrole-3-carboxamide Formula: C17H19FIN3O3 MolecularWeight: 459.253933

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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)NCCCO

Isomeric SMILES

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

InChI

InChI=1S/C17H19FIN3O3/c1-10(24)15-9-12(17(25)20-6-3-7-23)16(22(15)2)21-14-5-4-11(19)8-13(14)18/h4-5,8-9,21,23H,3,6-7H2,1-2H3,(H,20,25)