2-(3-cyanophenyl)-4,5-diethyl-pyrazole-3-carboxylate

Systemtic Name: 2-(3-cyanophenyl)-4,5-diethyl-pyrazole-3-carboxylate Openeye Name: 2-(3-cyanophenyl)-4,5-diethyl-pyrazole-3-carboxylate CAS Name: 2-(3-cyanophenyl)-4,5-diethyl-3-pyrazolecarboxylate IUPAC Name: 2-(3-cyanophenyl)-4,5-diethylpyrazole-3-carboxylate Traditional Name: 2-(3-cyanophenyl)-4,5-diethyl-pyrazole-3-carboxylate Formula: C15H14N3O2- MolecularWeight: 268.29056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(N=C1CC)C2=CC=CC(=C2)C#N)C(=O)[O-]

Isomeric SMILES

CCC1=C(N(N=C1CC)C2=CC=CC(=C2)C#N)C(=O)[O-]

InChI

InChI=1S/C15H15N3O2/c1-3-12-13(4-2)17-18(14(12)15(19)20)11-7-5-6-10(8-11)9-16/h5-8H,3-4H2,1-2H3,(H,19,20)/p-1