4-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid

Systemtic Name: 4-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid Openeye Name: 4-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid CAS Name: 4-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid IUPAC Name: 4-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid Traditional Name: 4-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]butyric acid Formula: C12H11N3O5 MolecularWeight: 277.23284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=NOC(=N2)CCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=NOC(=N2)CCCC(=O)O

InChI

InChI=1S/C12H11N3O5/c16-11(17)6-2-5-10-13-12(14-20-10)8-3-1-4-9(7-8)15(18)19/h1,3-4,7H,2,5-6H2,(H,16,17)