2-(phenylmethyl)-3-pyrazol-1-yl-propanoate

Systemtic Name: 2-(phenylmethyl)-3-pyrazol-1-yl-propanoate Openeye Name: 2-benzyl-3-pyrazol-1-yl-propanoate CAS Name: 2-(phenylmethyl)-3-(1-pyrazolyl)propanoate IUPAC Name: 2-benzyl-3-pyrazol-1-ylpropanoate Traditional Name: 2-benzyl-3-pyrazol-1-yl-propionate Formula: C13H13N2O2- MolecularWeight: 229.25452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CN2C=CC=N2)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC(CN2C=CC=N2)C(=O)[O-]

InChI

InChI=1S/C13H14N2O2/c16-13(17)12(10-15-8-4-7-14-15)9-11-5-2-1-3-6-11/h1-8,12H,9-10H2,(H,16,17)/p-1