3-(1,3-benzodioxol-5-ylmethyl)-1,4-dihydropyrazol-5-one

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-1,4-dihydropyrazol-5-one Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-1,4-dihydropyrazol-5-one CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-1,4-dihydropyrazol-5-one IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-1,4-dihydropyrazol-5-one Traditional Name: 5-piperonyl-2-pyrazolin-3-one Formula: C11H10N2O3 MolecularWeight: 218.2087

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NNC1=O)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1C(=NNC1=O)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C11H10N2O3/c14-11-5-8(12-13-11)3-7-1-2-9-10(4-7)16-6-15-9/h1-2,4H,3,5-6H2,(H,13,14)