[4-(1,2,4-triazol-4-yliminomethyl)phenyl] 2-fluoranylbenzoate

Systemtic Name: [4-(1,2,4-triazol-4-yliminomethyl)phenyl] 2-fluoranylbenzoate Openeye Name: [4-(1,2,4-triazol-4-yliminomethyl)phenyl] 2-fluorobenzoate CAS Name: 2-fluorobenzoic acid [4-(1,2,4-triazol-4-yliminomethyl)phenyl] ester IUPAC Name: [4-(1,2,4-triazol-4-yliminomethyl)phenyl] 2-fluorobenzoate Traditional Name: 2-fluorobenzoic acid [4-(1,2,4-triazol-4-yliminomethyl)phenyl] ester Formula: C16H11FN4O2 MolecularWeight: 310.282543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OC2=CC=C(C=C2)C=NN3C=NN=C3)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OC2=CC=C(C=C2)C=NN3C=NN=C3)F

InChI

InChI=1S/C16H11FN4O2/c17-15-4-2-1-3-14(15)16(22)23-13-7-5-12(6-8-13)9-20-21-10-18-19-11-21/h1-11H