cyanomethyl 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylate

Systemtic Name: cyanomethyl 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylate Openeye Name: cyanomethyl 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylate CAS Name: 5-cyclopropyl-2-phenyl-3-pyrazolecarboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl 5-cyclopropyl-2-phenylpyrazole-3-carboxylate Traditional Name: 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylic acid cyanomethyl ester Formula: C15H13N3O2 MolecularWeight: 267.28262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN(C(=C2)C(=O)OCC#N)C3=CC=CC=C3

Isomeric SMILES

C1CC1C2=NN(C(=C2)C(=O)OCC#N)C3=CC=CC=C3

InChI

InChI=1S/C15H13N3O2/c16-8-9-20-15(19)14-10-13(11-6-7-11)17-18(14)12-4-2-1-3-5-12/h1-5,10-11H,6-7,9H2