4-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]-3-nitro-benzoic acid

Systemtic Name: 4-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]-3-nitro-benzoic acid Openeye Name: 4-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]-3-nitro-benzoic acid CAS Name: 4-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]-3-nitrobenzoic acid IUPAC Name: 4-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]-3-nitrobenzoic acid Traditional Name: 4-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]-3-nitro-benzoic acid Formula: C19H17N3O5 MolecularWeight: 367.35538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(O2)C3=C(C=C(C=C3)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(O2)C3=C(C=C(C=C3)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O5/c1-19(2,3)13-7-4-11(5-8-13)16-20-21-17(27-16)14-9-6-12(18(23)24)10-15(14)22(25)26/h4-10H,1-3H3,(H,23,24)