1-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propan-1-one

Systemtic Name: 1-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propan-1-one Openeye Name: 1-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-3-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]propan-1-one CAS Name: 1-[4-[1,3-benzodioxol-5-yl(oxo)methyl]-1-piperazinyl]-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)-1-propanone IUPAC Name: 1-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propan-1-one Traditional Name: 1-(4-piperonyloylpiperazino)-3-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]propan-1-one Formula: C22H21N5O5 MolecularWeight: 435.43264

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC2=NC(=NO2)C3=CC=NC=C3)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCN1C(=O)CCC2=NC(=NO2)C3=CC=NC=C3)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H21N5O5/c28-20(4-3-19-24-21(25-32-19)15-5-7-23-8-6-15)26-9-11-27(12-10-26)22(29)16-1-2-17-18(13-16)31-14-30-17/h1-2,5-8,13H,3-4,9-12,14H2