2-phenyl-5-propoxy-4H-pyrazol-3-one

Systemtic Name: 2-phenyl-5-propoxy-4H-pyrazol-3-one Openeye Name: 2-phenyl-5-propoxy-4H-pyrazol-3-one CAS Name: 2-phenyl-5-propoxy-4H-pyrazol-3-one IUPAC Name: 2-phenyl-5-propoxy-4H-pyrazol-3-one Traditional Name: 2-phenyl-5-propoxy-2-pyrazolin-3-one Formula: C12H14N2O2 MolecularWeight: 218.25176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NN(C(=O)C1)C2=CC=CC=C2

Isomeric SMILES

CCCOC1=NN(C(=O)C1)C2=CC=CC=C2

InChI

InChI=1S/C12H14N2O2/c1-2-8-16-11-9-12(15)14(13-11)10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3