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

Systemtic Name: 2-(4-chloranyl-2-fluoranyl-5-nitro-phenyl)-4,5,6,7-tetrahydro-3aH-indazol-3-one Openeye Name: 2-(4-chloro-2-fluoro-5-nitro-phenyl)-4,5,6,7-tetrahydro-3aH-indazol-3-one CAS Name: 2-(4-chloro-2-fluoro-5-nitrophenyl)-4,5,6,7-tetrahydro-3aH-indazol-3-one IUPAC Name: 2-(4-chloro-2-fluoro-5-nitrophenyl)-4,5,6,7-tetrahydro-3aH-indazol-3-one Traditional Name: 2-(4-chloro-2-fluoro-5-nitro-phenyl)-4,5,6,7-tetrahydro-3aH-indazol-3-one Formula: C13H11ClFN3O3 MolecularWeight: 311.696143

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NN(C(=O)C2C1)C3=CC(=C(C=C3F)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCC2=NN(C(=O)C2C1)C3=CC(=C(C=C3F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H11ClFN3O3/c14-8-5-9(15)12(6-11(8)18(20)21)17-13(19)7-3-1-2-4-10(7)16-17/h5-7H,1-4H2