(1-cyanoindolizin-2-yl)methyl 1,3,5-trimethylpyrazole-4-carboxylate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 1,3,5-trimethylpyrazole-4-carboxylate Openeye Name: (1-cyanoindolizin-2-yl)methyl 1,3,5-trimethylpyrazole-4-carboxylate CAS Name: 1,3,5-trimethyl-4-pyrazolecarboxylic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 1,3,5-trimethylpyrazole-4-carboxylate Traditional Name: 1,3,5-trimethylpyrazole-4-carboxylic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C17H16N4O2 MolecularWeight: 308.33454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C(=O)OCC2=CN3C=CC=CC3=C2C#N

Isomeric SMILES

CC1=C(C(=NN1C)C)C(=O)OCC2=CN3C=CC=CC3=C2C#N

InChI

InChI=1S/C17H16N4O2/c1-11-16(12(2)20(3)19-11)17(22)23-10-13-9-21-7-5-4-6-15(21)14(13)8-18/h4-7,9H,10H2,1-3H3