4-[(2-chloranyl-4-iodanyl-phenyl)amino]-5,6-bis(fluoranyl)-1,2-dihydroindazol-3-one

Systemtic Name: 4-[(2-chloranyl-4-iodanyl-phenyl)amino]-5,6-bis(fluoranyl)-1,2-dihydroindazol-3-one Openeye Name: 4-(2-chloro-4-iodo-anilino)-5,6-difluoro-1,2-dihydroindazol-3-one CAS Name: 4-(2-chloro-4-iodoanilino)-5,6-difluoro-1,2-dihydroindazol-3-one IUPAC Name: 4-(2-chloro-4-iodoanilino)-5,6-difluoro-1,2-dihydroindazol-3-one Traditional Name: 4-(2-chloro-4-iodo-anilino)-5,6-difluoro-indazolin-3-one Formula: C13H7ClF2IN3O MolecularWeight: 421.568456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1I)Cl)NC2=C3C(=CC(=C2F)F)NNC3=O

Isomeric SMILES

C1=CC(=C(C=C1I)Cl)NC2=C3C(=CC(=C2F)F)NNC3=O

InChI

InChI=1S/C13H7ClF2IN3O/c14-6-3-5(17)1-2-8(6)18-12-10-9(19-20-13(10)21)4-7(15)11(12)16/h1-4,18H,(H2,19,20,21)