ethyl 4-[[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl]piperazine-1-carboxylate CAS Name: 4-[[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl]piperazine-1-carboxylate Traditional Name: 4-[[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl]piperazine-1-carboxylic acid ethyl ester Formula: C17H20N4O5 MolecularWeight: 360.3645

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC2=NC(=NO2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC2=NC(=NO2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H20N4O5/c1-2-23-17(22)21-7-5-20(6-8-21)10-15-18-16(19-26-15)12-3-4-13-14(9-12)25-11-24-13/h3-4,9H,2,5-8,10-11H2,1H3