ethyl (6Z)-1-(2-cyanoethyl)-6-(phenylmethylidene)-4,5-dihydrocyclopenta[c]pyrazole-3-carboxylate

Systemtic Name: ethyl (6Z)-1-(2-cyanoethyl)-6-(phenylmethylidene)-4,5-dihydrocyclopenta[c]pyrazole-3-carboxylate Openeye Name: ethyl (6Z)-6-benzylidene-1-(2-cyanoethyl)-4,5-dihydrocyclopenta[c]pyrazole-3-carboxylate CAS Name: (6Z)-1-(2-cyanoethyl)-6-(phenylmethylene)-4,5-dihydrocyclopenta[c]pyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (6Z)-6-benzylidene-1-(2-cyanoethyl)-4,5-dihydrocyclopenta[c]pyrazole-3-carboxylate Traditional Name: (6Z)-6-benzal-1-(2-cyanoethyl)-4,5-dihydrocyclopenta[c]pyrazole-3-carboxylic acid ethyl ester Formula: C19H19N3O2 MolecularWeight: 321.37306

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C2=C1CCC2=CC3=CC=CC=C3)CCC#N

Isomeric SMILES

CCOC(=O)C1=NN(C\2=C1CC/C2=C/C3=CC=CC=C3)CCC#N

InChI

InChI=1S/C19H19N3O2/c1-2-24-19(23)17-16-10-9-15(13-14-7-4-3-5-8-14)18(16)22(21-17)12-6-11-20/h3-5,7-8,13H,2,6,9-10,12H2,1H3/b15-13-