3-methyl-6-[5-(2-methyl-3-nitro-phenyl)-1,2,4-oxadiazol-3-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-methyl-6-[5-(2-methyl-3-nitro-phenyl)-1,2,4-oxadiazol-3-yl]-1H-benzimidazol-2-one Openeye Name: 3-methyl-6-[5-(2-methyl-3-nitro-phenyl)-1,2,4-oxadiazol-3-yl]-1H-benzimidazol-2-one CAS Name: 3-methyl-6-[5-(2-methyl-3-nitrophenyl)-1,2,4-oxadiazol-3-yl]-1H-benzimidazol-2-one IUPAC Name: 3-methyl-6-[5-(2-methyl-3-nitrophenyl)-1,2,4-oxadiazol-3-yl]-1H-benzimidazol-2-one Traditional Name: 3-methyl-6-[5-(2-methyl-3-nitro-phenyl)-1,2,4-oxadiazol-3-yl]-1H-benzimidazol-2-one Formula: C17H13N5O4 MolecularWeight: 351.31622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C2=NC(=NO2)C3=CC4=C(C=C3)N(C(=O)N4)C

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C2=NC(=NO2)C3=CC4=C(C=C3)N(C(=O)N4)C

InChI

InChI=1S/C17H13N5O4/c1-9-11(4-3-5-13(9)22(24)25)16-19-15(20-26-16)10-6-7-14-12(8-10)18-17(23)21(14)2/h3-8H,1-2H3,(H,18,23)