[4-[[2-(4-iodophenyl)-1,3-benzoxazol-5-yl]iminomethyl]phenyl] 4-fluoranylbenzoate

Systemtic Name: [4-[[2-(4-iodophenyl)-1,3-benzoxazol-5-yl]iminomethyl]phenyl] 4-fluoranylbenzoate Openeye Name: [4-[[2-(4-iodophenyl)-1,3-benzoxazol-5-yl]iminomethyl]phenyl] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [4-[[2-(4-iodophenyl)-1,3-benzoxazol-5-yl]iminomethyl]phenyl] ester IUPAC Name: [4-[[2-(4-iodophenyl)-1,3-benzoxazol-5-yl]iminomethyl]phenyl] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [4-[[2-(4-iodophenyl)-1,3-benzoxazol-5-yl]iminomethyl]phenyl] ester Formula: C27H16FIN2O3 MolecularWeight: 562.330413

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=NC2=CC3=C(C=C2)OC(=N3)C4=CC=C(C=C4)I)OC(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1=CC(=CC=C1C=NC2=CC3=C(C=C2)OC(=N3)C4=CC=C(C=C4)I)OC(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H16FIN2O3/c28-20-7-3-19(4-8-20)27(32)33-23-12-1-17(2-13-23)16-30-22-11-14-25-24(15-22)31-26(34-25)18-5-9-21(29)10-6-18/h1-16H