[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl 3-nitro-4-piperidin-1-yl-benzoate

Systemtic Name: [5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl 3-nitro-4-piperidin-1-yl-benzoate Openeye Name: [5-(2-furyl)-1,3,4-oxadiazol-2-yl]methyl 3-nitro-4-(1-piperidyl)benzoate CAS Name: 3-nitro-4-(1-piperidinyl)benzoic acid [5-(2-furanyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl 3-nitro-4-piperidin-1-ylbenzoate Traditional Name: 3-nitro-4-piperidino-benzoic acid [5-(2-furyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C19H18N4O6 MolecularWeight: 398.36942

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC3=NN=C(O3)C4=CC=CO4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC3=NN=C(O3)C4=CC=CO4)[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O6/c24-19(28-12-17-20-21-18(29-17)16-5-4-10-27-16)13-6-7-14(15(11-13)23(25)26)22-8-2-1-3-9-22/h4-7,10-11H,1-3,8-9,12H2