3-chloranyl-2-(4-chloranyl-2-fluoranyl-5-phenylmethoxy-phenyl)-4,5,6,7-tetrahydroindazole

Systemtic Name: 3-chloranyl-2-(4-chloranyl-2-fluoranyl-5-phenylmethoxy-phenyl)-4,5,6,7-tetrahydroindazole Openeye Name: 2-(5-benzyloxy-4-chloro-2-fluoro-phenyl)-3-chloro-4,5,6,7-tetrahydroindazole CAS Name: 3-chloro-2-(4-chloro-2-fluoro-5-phenylmethoxyphenyl)-4,5,6,7-tetrahydroindazole IUPAC Name: 3-chloro-2-(4-chloro-2-fluoro-5-phenylmethoxyphenyl)-4,5,6,7-tetrahydroindazole Traditional Name: 2-(5-benzoxy-4-chloro-2-fluoro-phenyl)-3-chloro-4,5,6,7-tetrahydroindazole Formula: C20H17Cl2FN2O MolecularWeight: 391.266183

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NN(C(=C2C1)Cl)C3=CC(=C(C=C3F)Cl)OCC4=CC=CC=C4

Isomeric SMILES

C1CCC2=NN(C(=C2C1)Cl)C3=CC(=C(C=C3F)Cl)OCC4=CC=CC=C4

InChI

InChI=1S/C20H17Cl2FN2O/c21-15-10-16(23)18(11-19(15)26-12-13-6-2-1-3-7-13)25-20(22)14-8-4-5-9-17(14)24-25/h1-3,6-7,10-11H,4-5,8-9,12H2