1-[4-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]-3-nitro-phenyl]ethanone

Systemtic Name: 1-[4-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]-3-nitro-phenyl]ethanone Openeye Name: 1-[4-[[5-(2-furyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-3-nitro-phenyl]ethanone CAS Name: 1-[4-[[5-(2-furanyl)-1,3,4-oxadiazol-2-yl]thio]-3-nitrophenyl]ethanone IUPAC Name: 1-[4-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]-3-nitrophenyl]ethanone Traditional Name: 1-[4-[[5-(2-furyl)-1,3,4-oxadiazol-2-yl]thio]-3-nitro-phenyl]ethanone Formula: C14H9N3O5S MolecularWeight: 331.30336

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)SC2=NN=C(O2)C3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)SC2=NN=C(O2)C3=CC=CO3)[N+](=O)[O-]

InChI

InChI=1S/C14H9N3O5S/c1-8(18)9-4-5-12(10(7-9)17(19)20)23-14-16-15-13(22-14)11-3-2-6-21-11/h2-7H,1H3