2-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]benzoic acid

Systemtic Name: 2-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]benzoic acid Openeye Name: 2-[3-(4-isopropylphenyl)-1,2,4-oxadiazol-5-yl]benzoic acid CAS Name: 2-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]benzoic acid IUPAC Name: 2-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]benzoic acid Traditional Name: 2-(3-p-cumenyl-1,2,4-oxadiazol-5-yl)benzoic acid Formula: C18H16N2O3 MolecularWeight: 308.33124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)C3=CC=CC=C3C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C18H16N2O3/c1-11(2)12-7-9-13(10-8-12)16-19-17(23-20-16)14-5-3-4-6-15(14)18(21)22/h3-11H,1-2H3,(H,21,22)