5-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-3-ethyl-1,2,4-oxadiazole

Systemtic Name: 5-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-3-ethyl-1,2,4-oxadiazole Openeye Name: 5-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-3-ethyl-1,2,4-oxadiazole CAS Name: 5-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]methyl]-3-ethyl-1,2,4-oxadiazole IUPAC Name: 5-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-3-ethyl-1,2,4-oxadiazole Traditional Name: 3-ethyl-5-[(4-piperonylpiperazino)methyl]-1,2,4-oxadiazole Formula: C17H22N4O3 MolecularWeight: 330.38158

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=N1)CN2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCC1=NOC(=N1)CN2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H22N4O3/c1-2-16-18-17(24-19-16)11-21-7-5-20(6-8-21)10-13-3-4-14-15(9-13)23-12-22-14/h3-4,9H,2,5-8,10-12H2,1H3