ethyl 2-(2-cyanoethyl)-5-(4-methoxyphenyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 2-(2-cyanoethyl)-5-(4-methoxyphenyl)pyrazole-3-carboxylate Openeye Name: ethyl 2-(2-cyanoethyl)-5-(4-methoxyphenyl)pyrazole-3-carboxylate CAS Name: 2-(2-cyanoethyl)-5-(4-methoxyphenyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(2-cyanoethyl)-5-(4-methoxyphenyl)pyrazole-3-carboxylate Traditional Name: 2-(2-cyanoethyl)-5-(4-methoxyphenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C16H17N3O3 MolecularWeight: 299.32448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NN1CCC#N)C2=CC=C(C=C2)OC

Isomeric SMILES

CCOC(=O)C1=CC(=NN1CCC#N)C2=CC=C(C=C2)OC

InChI

InChI=1S/C16H17N3O3/c1-3-22-16(20)15-11-14(18-19(15)10-4-9-17)12-5-7-13(21-2)8-6-12/h5-8,11H,3-4,10H2,1-2H3