3-[[3-(1-ethyl-3-methyl-pyrazol-4-yl)pyrazol-1-yl]methyl]benzoate

Systemtic Name: 3-[[3-(1-ethyl-3-methyl-pyrazol-4-yl)pyrazol-1-yl]methyl]benzoate Openeye Name: 3-[[3-(1-ethyl-3-methyl-pyrazol-4-yl)pyrazol-1-yl]methyl]benzoate CAS Name: 3-[[3-(1-ethyl-3-methyl-4-pyrazolyl)-1-pyrazolyl]methyl]benzoate IUPAC Name: 3-[[3-(1-ethyl-3-methylpyrazol-4-yl)pyrazol-1-yl]methyl]benzoate Traditional Name: 3-[[3-(1-ethyl-3-methyl-pyrazol-4-yl)pyrazol-1-yl]methyl]benzoate Formula: C17H17N4O2- MolecularWeight: 309.34248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)C2=NN(C=C2)CC3=CC=CC(=C3)C(=O)[O-]

Isomeric SMILES

CCN1C=C(C(=N1)C)C2=NN(C=C2)CC3=CC=CC(=C3)C(=O)[O-]

InChI

InChI=1S/C17H18N4O2/c1-3-20-11-15(12(2)18-20)16-7-8-21(19-16)10-13-5-4-6-14(9-13)17(22)23/h4-9,11H,3,10H2,1-2H3,(H,22,23)/p-1