1-[5-[(2-fluoranyl-4-iodanyl-phenyl)amino]-1-methyl-4-[(3S)-3-oxidanylpyrrolidin-1-yl]carbonyl-pyrrol-2-yl]ethanone

Systemtic Name: 1-[5-[(2-fluoranyl-4-iodanyl-phenyl)amino]-1-methyl-4-[(3S)-3-oxidanylpyrrolidin-1-yl]carbonyl-pyrrol-2-yl]ethanone Openeye Name: 1-[5-(2-fluoro-4-iodo-anilino)-4-[(3S)-3-hydroxypyrrolidine-1-carbonyl]-1-methyl-pyrrol-2-yl]ethanone CAS Name: 1-[5-(2-fluoro-4-iodoanilino)-4-[[(3S)-3-hydroxy-1-pyrrolidinyl]-oxomethyl]-1-methyl-2-pyrrolyl]ethanone IUPAC Name: 1-[5-(2-fluoro-4-iodoanilino)-4-[(3S)-3-hydroxypyrrolidine-1-carbonyl]-1-methylpyrrol-2-yl]ethanone Traditional Name: 1-[5-(2-fluoro-4-iodo-anilino)-4-[(3S)-3-hydroxypyrrolidine-1-carbonyl]-1-methyl-pyrrol-2-yl]ethanone Formula: C18H19FIN3O3 MolecularWeight: 471.264633

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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)N3CCC(C3)O

Isomeric SMILES

CC(=O)C1=CC(=C(N1C)NC2=C(C=C(C=C2)I)F)C(=O)N3CC[C@@H](C3)O

InChI

InChI=1S/C18H19FIN3O3/c1-10(24)16-8-13(18(26)23-6-5-12(25)9-23)17(22(16)2)21-15-4-3-11(20)7-14(15)19/h3-4,7-8,12,21,25H,5-6,9H2,1-2H3/t12-/m0/s1