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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-])F

InChI

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