[(1R)-1-cyanoethyl] 4-methoxy-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: [(1R)-1-cyanoethyl] 4-methoxy-1-phenyl-pyrazole-3-carboxylate Openeye Name: [(1R)-1-cyanoethyl] 4-methoxy-1-phenyl-pyrazole-3-carboxylate CAS Name: 4-methoxy-1-phenyl-3-pyrazolecarboxylic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] 4-methoxy-1-phenylpyrazole-3-carboxylate Traditional Name: 4-methoxy-1-phenyl-pyrazole-3-carboxylic acid [(1R)-1-cyanoethyl] ester Formula: C14H13N3O3 MolecularWeight: 271.27132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)C1=NN(C=C1OC)C2=CC=CC=C2

Isomeric SMILES

C[C@H](C#N)OC(=O)C1=NN(C=C1OC)C2=CC=CC=C2

InChI

InChI=1S/C14H13N3O3/c1-10(8-15)20-14(18)13-12(19-2)9-17(16-13)11-6-4-3-5-7-11/h3-7,9-10H,1-2H3/t10-/m1/s1