2-(4-chloranyl-2-fluoranyl-5-oxidanyl-phenyl)-4,5,6,7-tetrahydro-3aH-indazol-3-one

Systemtic Name: 2-(4-chloranyl-2-fluoranyl-5-oxidanyl-phenyl)-4,5,6,7-tetrahydro-3aH-indazol-3-one Openeye Name: 2-(4-chloro-2-fluoro-5-hydroxy-phenyl)-4,5,6,7-tetrahydro-3aH-indazol-3-one CAS Name: 2-(4-chloro-2-fluoro-5-hydroxyphenyl)-4,5,6,7-tetrahydro-3aH-indazol-3-one IUPAC Name: 2-(4-chloro-2-fluoro-5-hydroxyphenyl)-4,5,6,7-tetrahydro-3aH-indazol-3-one Traditional Name: 2-(4-chloro-2-fluoro-5-hydroxy-phenyl)-4,5,6,7-tetrahydro-3aH-indazol-3-one Formula: C13H12ClFN2O2 MolecularWeight: 282.697983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NN(C(=O)C2C1)C3=CC(=C(C=C3F)Cl)O

Isomeric SMILES

C1CCC2=NN(C(=O)C2C1)C3=CC(=C(C=C3F)Cl)O

InChI

InChI=1S/C13H12ClFN2O2/c14-8-5-9(15)11(6-12(8)18)17-13(19)7-3-1-2-4-10(7)16-17/h5-7,18H,1-4H2