ethyl 5-(2,2-dicyanoethenylamino)-1-(4-fluorophenyl)pyrazole-4-carboxylate

Systemtic Name: ethyl 5-(2,2-dicyanoethenylamino)-1-(4-fluorophenyl)pyrazole-4-carboxylate Openeye Name: ethyl 5-(2,2-dicyanovinylamino)-1-(4-fluorophenyl)pyrazole-4-carboxylate CAS Name: 5-(2,2-dicyanoethenylamino)-1-(4-fluorophenyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(2,2-dicyanoethenylamino)-1-(4-fluorophenyl)pyrazole-4-carboxylate Traditional Name: 5-(2,2-dicyanovinylamino)-1-(4-fluorophenyl)pyrazole-4-carboxylic acid ethyl ester Formula: C16H12FN5O2 MolecularWeight: 325.297183

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)F)NC=C(C#N)C#N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)F)NC=C(C#N)C#N

InChI

InChI=1S/C16H12FN5O2/c1-2-24-16(23)14-10-21-22(13-5-3-12(17)4-6-13)15(14)20-9-11(7-18)8-19/h3-6,9-10,20H,2H2,1H3