4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-1,2-dihydropyrazol-3-one

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-1,2-dihydropyrazol-3-one Openeye Name: 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-1,2-dihydropyrazol-3-one CAS Name: 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-1,2-dihydropyrazol-3-one IUPAC Name: 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-1,2-dihydropyrazol-3-one Traditional Name: 5-methyl-4-piperonyl-3-pyrazolin-3-one Formula: C12H12N2O3 MolecularWeight: 232.23528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN1)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=C(C(=O)NN1)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C12H12N2O3/c1-7-9(12(15)14-13-7)4-8-2-3-10-11(5-8)17-6-16-10/h2-3,5H,4,6H2,1H3,(H2,13,14,15)