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

Systemtic Name: ethyl 1-[[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidine-3-carboxylate CAS Name: 1-[[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidine-3-carboxylate Traditional Name: 1-[[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl]nipecotic acid ethyl ester Formula: C17H20N4O5 MolecularWeight: 360.3645

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CC2=NC(=NO2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CCCN(C1)CC2=NC(=NO2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

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