N-[1-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-4-nitro-benzamide

Systemtic Name: N-[1-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-4-nitro-benzamide Openeye Name: N-[1-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-4-nitro-benzamide CAS Name: N-[1-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-4-nitrobenzamide IUPAC Name: N-[1-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-4-nitrobenzamide Traditional Name: N-[1-(2-fluorobenzyl)-1,2,4-triazol-3-yl]-4-nitro-benzamide Formula: C16H12FN5O3 MolecularWeight: 341.296583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=NC(=N2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])F

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=NC(=N2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])F

InChI

InChI=1S/C16H12FN5O3/c17-14-4-2-1-3-12(14)9-21-10-18-16(20-21)19-15(23)11-5-7-13(8-6-11)22(24)25/h1-8,10H,9H2,(H,19,20,23)