N-[5-(2-bromophenyl)-1H-1,2,4-triazol-3-yl]-4-nitro-benzamide

Systemtic Name: N-[5-(2-bromophenyl)-1H-1,2,4-triazol-3-yl]-4-nitro-benzamide Openeye Name: N-[5-(2-bromophenyl)-1H-1,2,4-triazol-3-yl]-4-nitro-benzamide CAS Name: N-[5-(2-bromophenyl)-1H-1,2,4-triazol-3-yl]-4-nitrobenzamide IUPAC Name: N-[5-(2-bromophenyl)-1H-1,2,4-triazol-3-yl]-4-nitrobenzamide Traditional Name: N-[5-(2-bromophenyl)-1H-1,2,4-triazol-3-yl]-4-nitro-benzamide Formula: C15H10BrN5O3 MolecularWeight: 388.1756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC(=NN2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC(=NN2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C15H10BrN5O3/c16-12-4-2-1-3-11(12)13-17-15(20-19-13)18-14(22)9-5-7-10(8-6-9)21(23)24/h1-8H,(H2,17,18,19,20,22)