5-chloranyl-4-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperazin-1-yl]-1H-pyridazin-6-one

Systemtic Name: 5-chloranyl-4-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperazin-1-yl]-1H-pyridazin-6-one Openeye Name: 5-chloro-4-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperazin-1-yl]-1H-pyridazin-6-one CAS Name: 5-chloro-4-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-piperazinyl]-1H-pyridazin-6-one IUPAC Name: 5-chloro-4-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperazin-1-yl]-1H-pyridazin-6-one Traditional Name: 5-chloro-4-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperazino]-1H-pyridazin-6-one Formula: C17H19ClN4O3 MolecularWeight: 362.81076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2COC3=CC=CC=C3O2)C4=C(C(=O)NN=C4)Cl

Isomeric SMILES

C1CN(CCN1CC2COC3=CC=CC=C3O2)C4=C(C(=O)NN=C4)Cl

InChI

InChI=1S/C17H19ClN4O3/c18-16-13(9-19-20-17(16)23)22-7-5-21(6-8-22)10-12-11-24-14-3-1-2-4-15(14)25-12/h1-4,9,12H,5-8,10-11H2,(H,20,23)