(2-methoxy-2-oxidanylidene-ethyl) 1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate

Systemtic Name: (2-methoxy-2-oxidanylidene-ethyl) 1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate Openeye Name: (2-methoxy-2-oxo-ethyl) 1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate CAS Name: 1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxylic acid (2-methoxy-2-oxoethyl) ester IUPAC Name: (2-methoxy-2-oxoethyl) 1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate Traditional Name: 1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxylic acid (2-keto-2-methoxy-ethyl) ester Formula: C17H17FN2O4 MolecularWeight: 332.326283

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC(=O)C1=NN(C2=C1CCCC2)C3=CC=C(C=C3)F

Isomeric SMILES

COC(=O)COC(=O)C1=NN(C2=C1CCCC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H17FN2O4/c1-23-15(21)10-24-17(22)16-13-4-2-3-5-14(13)20(19-16)12-8-6-11(18)7-9-12/h6-9H,2-5,10H2,1H3