ethyl 4-(2-ethoxy-2-oxidanylidene-ethyl)-8-naphthalen-1-yl-pyrazolo[5,1-c][1,2,4]triazine-3-carboxylate

Systemtic Name: ethyl 4-(2-ethoxy-2-oxidanylidene-ethyl)-8-naphthalen-1-yl-pyrazolo[5,1-c][1,2,4]triazine-3-carboxylate Openeye Name: ethyl 4-(2-ethoxy-2-oxo-ethyl)-8-(1-naphthyl)pyrazolo[5,1-c][1,2,4]triazine-3-carboxylate CAS Name: 4-(2-ethoxy-2-oxoethyl)-8-(1-naphthalenyl)-3-pyrazolo[5,1-c][1,2,4]triazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-ethoxy-2-oxoethyl)-8-naphthalen-1-ylpyrazolo[5,1-c][1,2,4]triazine-3-carboxylate Traditional Name: 4-(2-ethoxy-2-keto-ethyl)-8-(1-naphthyl)pyrazolo[5,1-c][1,2,4]triazine-3-carboxylic acid ethyl ester Formula: C22H20N4O4 MolecularWeight: 404.4186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(N=NC2=C(C=NN12)C3=CC=CC4=CC=CC=C43)C(=O)OCC

Isomeric SMILES

CCOC(=O)CC1=C(N=NC2=C(C=NN12)C3=CC=CC4=CC=CC=C43)C(=O)OCC

InChI

InChI=1S/C22H20N4O4/c1-3-29-19(27)12-18-20(22(28)30-4-2)24-25-21-17(13-23-26(18)21)16-11-7-9-14-8-5-6-10-15(14)16/h5-11,13H,3-4,12H2,1-2H3