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

Systemtic Name: 2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-nitro-benzoic acid Openeye Name: 2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-nitro-benzoic acid CAS Name: 2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-nitrobenzoic acid IUPAC Name: 2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-nitrobenzoic acid Traditional Name: 2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-nitro-benzoic acid Formula: C15H8ClN3O5 MolecularWeight: 345.69412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)[N+](=O)[O-])C2=NC(=NO2)C3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1)[N+](=O)[O-])C2=NC(=NO2)C3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C15H8ClN3O5/c16-9-6-4-8(5-7-9)13-17-14(24-18-13)12-10(15(20)21)2-1-3-11(12)19(22)23/h1-7H,(H,20,21)