1-azabicyclo[3.1.0]hexane; N-ethyl-5-fluoranyl-2-[(4-iodanyl-2-methyl-phenyl)amino]benzamide

Systemtic Name: 1-azabicyclo[3.1.0]hexane; N-ethyl-5-fluoranyl-2-[(4-iodanyl-2-methyl-phenyl)amino]benzamide Openeye Name: 1-azabicyclo[3.1.0]hexane; N-ethyl-5-fluoro-2-(4-iodo-2-methyl-anilino)benzamide CAS Name: 1-azabicyclo[3.1.0]hexane; N-ethyl-5-fluoro-2-(4-iodo-2-methylanilino)benzamide IUPAC Name: 1-azabicyclo[3.1.0]hexane; N-ethyl-5-fluoro-2-(4-iodo-2-methylanilino)benzamide Traditional Name: 1-azabicyclo[3.1.0]hexane; N-ethyl-5-fluoro-2-(4-iodo-2-methyl-anilino)benzamide Formula: C21H25FIN3O MolecularWeight: 481.345573

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=C(C=CC(=C1)F)NC2=C(C=C(C=C2)I)C.C1CC2CN2C1

Isomeric SMILES

CCNC(=O)C1=C(C=CC(=C1)F)NC2=C(C=C(C=C2)I)C.C1CC2CN2C1

InChI

InChI=1S/C16H16FIN2O.C5H9N/c1-3-19-16(21)13-9-11(17)4-6-15(13)20-14-7-5-12(18)8-10(14)2;1-2-5-4-6(5)3-1/h4-9,20H,3H2,1-2H3,(H,19,21);5H,1-4H2