tert-butyl 2-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: tert-butyl 2-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanoate Openeye Name: tert-butyl 2-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]thio]acetic acid tert-butyl ester Formula: C14H15N3O5S MolecularWeight: 337.351

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CSC1=NN=C(O1)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)CSC1=NN=C(O1)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H15N3O5S/c1-14(2,3)22-11(18)8-23-13-16-15-12(21-13)9-5-4-6-10(7-9)17(19)20/h4-7H,8H2,1-3H3