1-(1,3-benzodioxol-5-ylmethyl)-4-pyridin-3-ylcarbonyl-piperazin-2-one

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-pyridin-3-ylcarbonyl-piperazin-2-one Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(pyridine-3-carbonyl)piperazin-2-one CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[oxo(3-pyridinyl)methyl]-2-piperazinone IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(pyridine-3-carbonyl)piperazin-2-one Traditional Name: 4-nicotinoyl-1-piperonyl-piperazin-2-one Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)CN1C(=O)C2=CN=CC=C2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(C(=O)CN1C(=O)C2=CN=CC=C2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H17N3O4/c22-17-11-21(18(23)14-2-1-5-19-9-14)7-6-20(17)10-13-3-4-15-16(8-13)25-12-24-15/h1-5,8-9H,6-7,10-12H2