[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 3-thiophen-2-ylpropanoate

Systemtic Name: [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 3-thiophen-2-ylpropanoate Openeye Name: [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 3-(2-thienyl)propanoate CAS Name: 3-thiophen-2-ylpropanoic acid [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 3-thiophen-2-ylpropanoate Traditional Name: 3-(2-thienyl)propionic acid [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C16H13N3O5S MolecularWeight: 359.35652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCC(=O)OCC2=NN=C(O2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=C1)CCC(=O)OCC2=NN=C(O2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O5S/c20-15(8-7-13-2-1-9-25-13)23-10-14-17-18-16(24-14)11-3-5-12(6-4-11)19(21)22/h1-6,9H,7-8,10H2