4-chloranyl-2-fluoranyl-3-(3-prop-2-ynoxyphenyl)-4,5,6,7-tetrahydroindazole

Systemtic Name: 4-chloranyl-2-fluoranyl-3-(3-prop-2-ynoxyphenyl)-4,5,6,7-tetrahydroindazole Openeye Name: 4-chloro-2-fluoro-3-(3-prop-2-ynoxyphenyl)-4,5,6,7-tetrahydroindazole CAS Name: 4-chloro-2-fluoro-3-(3-prop-2-ynoxyphenyl)-4,5,6,7-tetrahydroindazole IUPAC Name: 4-chloro-2-fluoro-3-(3-prop-2-ynoxyphenyl)-4,5,6,7-tetrahydroindazole Traditional Name: 4-chloro-2-fluoro-3-(3-propargyloxyphenyl)-4,5,6,7-tetrahydroindazole Formula: C16H14ClFN2O MolecularWeight: 304.746563

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=CC=CC(=C1)C2=C3C(CCCC3=NN2F)Cl

Isomeric SMILES

C#CCOC1=CC=CC(=C1)C2=C3C(CCCC3=NN2F)Cl

InChI

InChI=1S/C16H14ClFN2O/c1-2-9-21-12-6-3-5-11(10-12)16-15-13(17)7-4-8-14(15)19-20(16)18/h1,3,5-6,10,13H,4,7-9H2