N-[3-[5-(2-fluorophenyl)-3-methoxy-1,2,4-triazol-1-yl]phenyl]-3-nitro-benzamide

Systemtic Name: N-[3-[5-(2-fluorophenyl)-3-methoxy-1,2,4-triazol-1-yl]phenyl]-3-nitro-benzamide Openeye Name: N-[3-[5-(2-fluorophenyl)-3-methoxy-1,2,4-triazol-1-yl]phenyl]-3-nitro-benzamide CAS Name: N-[3-[5-(2-fluorophenyl)-3-methoxy-1,2,4-triazol-1-yl]phenyl]-3-nitrobenzamide IUPAC Name: N-[3-[5-(2-fluorophenyl)-3-methoxy-1,2,4-triazol-1-yl]phenyl]-3-nitrobenzamide Traditional Name: N-[3-[5-(2-fluorophenyl)-3-methoxy-1,2,4-triazol-1-yl]phenyl]-3-nitro-benzamide Formula: C22H16FN5O4 MolecularWeight: 433.391943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN(C(=N1)C2=CC=CC=C2F)C3=CC(=CC=C3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=NN(C(=N1)C2=CC=CC=C2F)C3=CC(=CC=C3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H16FN5O4/c1-32-22-25-20(18-10-2-3-11-19(18)23)27(26-22)16-8-5-7-15(13-16)24-21(29)14-6-4-9-17(12-14)28(30)31/h2-13H,1H3,(H,24,29)