3-(4-ethylphenyl)-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: 3-(4-ethylphenyl)-1-phenyl-pyrazole-4-carboxylate Openeye Name: 3-(4-ethylphenyl)-1-phenyl-pyrazole-4-carboxylate CAS Name: 3-(4-ethylphenyl)-1-phenyl-4-pyrazolecarboxylate IUPAC Name: 3-(4-ethylphenyl)-1-phenylpyrazole-4-carboxylate Traditional Name: 3-(4-ethylphenyl)-1-phenyl-pyrazole-4-carboxylate Formula: C18H15N2O2- MolecularWeight: 291.3239

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NN(C=C2C(=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NN(C=C2C(=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C18H16N2O2/c1-2-13-8-10-14(11-9-13)17-16(18(21)22)12-20(19-17)15-6-4-3-5-7-15/h3-12H,2H2,1H3,(H,21,22)/p-1