ethanedioic acid; 2-(furan-2-yl)-5-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-1,3,4-oxadiazole

Systemtic Name: ethanedioic acid; 2-(furan-2-yl)-5-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-1,3,4-oxadiazole Openeye Name: 2-(2-furyl)-5-[[4-(2-pyridyl)piperazin-1-yl]methyl]-1,3,4-oxadiazole; oxalic acid CAS Name: 2-(2-furanyl)-5-[[4-(2-pyridinyl)-1-piperazinyl]methyl]-1,3,4-oxadiazole; oxalic acid IUPAC Name: 2-(furan-2-yl)-5-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-1,3,4-oxadiazole; oxalic acid Traditional Name: 2-(2-furyl)-5-[[4-(2-pyridyl)piperazino]methyl]-1,3,4-oxadiazole; oxalic acid Formula: C20H21N5O10 MolecularWeight: 491.40824

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NN=C(O2)C3=CC=CO3)C4=CC=CC=N4.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CC2=NN=C(O2)C3=CC=CO3)C4=CC=CC=N4.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H17N5O2.2C2H2O4/c1-2-6-17-14(5-1)21-9-7-20(8-10-21)12-15-18-19-16(23-15)13-4-3-11-22-13;2*3-1(4)2(5)6/h1-6,11H,7-10,12H2;2*(H,3,4)(H,5,6)