(2-phenyl-5-propyl-pyrazol-3-yl) 1,3-benzodioxole-5-carboxylate

Systemtic Name: (2-phenyl-5-propyl-pyrazol-3-yl) 1,3-benzodioxole-5-carboxylate Openeye Name: (2-phenyl-5-propyl-pyrazol-3-yl) 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid (2-phenyl-5-propyl-3-pyrazolyl) ester IUPAC Name: (2-phenyl-5-propylpyrazol-3-yl) 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid (2-phenyl-5-propyl-pyrazol-3-yl) ester Formula: C20H18N2O4 MolecularWeight: 350.36792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1)OC(=O)C2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

Isomeric SMILES

CCCC1=NN(C(=C1)OC(=O)C2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

InChI

InChI=1S/C20H18N2O4/c1-2-6-15-12-19(22(21-15)16-7-4-3-5-8-16)26-20(23)14-9-10-17-18(11-14)25-13-24-17/h3-5,7-12H,2,6,13H2,1H3