ethyl 1-methyl-8-(trifluoromethylsulfonyloxy)-4,5-dihydropyrazolo[4,3-h]quinazoline-3-carboxylate

Systemtic Name: ethyl 1-methyl-8-(trifluoromethylsulfonyloxy)-4,5-dihydropyrazolo[4,3-h]quinazoline-3-carboxylate Openeye Name: ethyl 1-methyl-8-(trifluoromethylsulfonyloxy)-4,5-dihydropyrazolo[4,3-h]quinazoline-3-carboxylate CAS Name: 1-methyl-8-(trifluoromethylsulfonyloxy)-4,5-dihydropyrazolo[4,3-h]quinazoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-methyl-8-(trifluoromethylsulfonyloxy)-4,5-dihydropyrazolo[4,3-h]quinazoline-3-carboxylate Traditional Name: 1-methyl-8-triflyloxy-4,5-dihydropyrazolo[4,3-h]quinazoline-3-carboxylic acid ethyl ester Formula: C14H13F3N4O5S MolecularWeight: 406.33703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C2=C1CCC3=CN=C(N=C32)OS(=O)(=O)C(F)(F)F)C

Isomeric SMILES

CCOC(=O)C1=NN(C2=C1CCC3=CN=C(N=C32)OS(=O)(=O)C(F)(F)F)C

InChI

InChI=1S/C14H13F3N4O5S/c1-3-25-12(22)10-8-5-4-7-6-18-13(26-27(23,24)14(15,16)17)19-9(7)11(8)21(2)20-10/h6H,3-5H2,1-2H3