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

Systemtic Name: N-[4-[3-ethoxy-5-(2-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]-3-nitro-benzamide Openeye Name: N-[4-[3-ethoxy-5-(2-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]-3-nitro-benzamide CAS Name: N-[4-[3-ethoxy-5-(2-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]-3-nitrobenzamide IUPAC Name: N-[4-[3-ethoxy-5-(2-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]-3-nitrobenzamide Traditional Name: N-[4-[3-ethoxy-5-(2-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]-3-nitro-benzamide Formula: C23H18FN5O4 MolecularWeight: 447.418523

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN(C(=N1)C2=CC=CC=C2F)C3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=NN(C(=N1)C2=CC=CC=C2F)C3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H18FN5O4/c1-2-33-23-26-21(19-8-3-4-9-20(19)24)28(27-23)17-12-10-16(11-13-17)25-22(30)15-6-5-7-18(14-15)29(31)32/h3-14H,2H2,1H3,(H,25,30)